SCHEMBL317463

SCHEMBL317463

COc1ccc2nc(C)cc(Cl)c2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.64
POLB P06746 4/20 0.60
KDM4E B2RXH2 3/20 0.60
HSD17B10 Q99714 3/20 0.60
HPGD P15428 2/20 0.60
ALDH1A1 P00352 2/20 0.60
NQO2 P16083 1/20 0.60
TP53 P04637 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
SLC2A1 P11166 1/20 0.59
RAD52 P43351 1/20 0.57
MAPT P10636 1/20 0.57
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
PKM P14618 1/20 0.54
PTPN11 Q06124 1/20 0.52
TSHR P16473 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CFTR P13569 1/20 0.49
BLM P54132 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL9732126 0.98 LMNA (0.62) LMNAPOLBKDM4EHSD17B10HPGD
SCHEMBL859440 0.86 MAPT (0.57) LMNAPOLBKDM4EHSD17B10HPGD
SCHEMBL830265 0.84 SMN1; SMN2 (0.48) LMNAPOLBKDM4EHSD17B10HPGD
SCHEMBL29420513 0.84 SMN1; SMN2 (0.48) LMNAPOLBKDM4EHSD17B10HPGD
SCHEMBL8103092 0.82 POLB (0.66) LMNAPOLBKDM4EHSD17B10HPGD
SCHEMBL3647767 0.82 MAPT (0.61) LMNAPOLBKDM4EHSD17B10HPGD
SCHEMBL23412192 0.81 NCF1 (0.56) LMNAPOLBKDM4EHSD17B10NQO2
SCHEMBL25912335 0.81 DHODH (0.48) LMNAPOLBKDM4EHSD17B10HPGD
SCHEMBL4748376 0.80 LMNA (0.55) LMNAPOLBKDM4EHSD17B10HPGD
SCHEMBL1043638 0.79 KDM4E (0.65) LMNAPOLBKDM4EHSD17B10HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11639335-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2023-05-02 US disclosed
US-11639335-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2023-05-02 US disclosed
US-11639335-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2023-05-02 US disclosed
US-20220064118-A1 Asymmetric Bisaminoquinolines And Bisaminoquinolines With Varied Linkers As Autophagy Inhibitors For Cancer And Other Therapy NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-03-03 US disclosed
US-20220064118-A1 Asymmetric Bisaminoquinolines And Bisaminoquinolines With Varied Linkers As Autophagy Inhibitors For Cancer And Other Therapy NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-03-03 US disclosed
EP-3649110-B1 MYCOBACTERIUM-TUBERCOLOSIS-THIOREDOXIN REDUCTASE INHIBITOR AS ANTITUBERCULOSIS DRUG UNIV DORTMUND TECH (DE) 2021-09-08 EP disclosed
US-11078185-B2 Mycobacterium tuberculosis—thioredoxin reductase inhibitor as an antitubercular agent TECHNISCHE UNIVERSITAT DORTMUND (DE) 2021-08-03 US disclosed
EP-3848355-A1 ASYMMETRIC BISAMINOQUINOLINES AND BISAMINOQUINOLINES WITH VARIED LINKERS AS AUTOPHAGY INHIBITORS FOR CANCER AND OTHER THERAPY The Trustees Of The University Of Pennsylvania (US) 2021-07-14 EP disclosed
EP-3848355-A1 ASYMMETRIC BISAMINOQUINOLINES AND BISAMINOQUINOLINES WITH VARIED LINKERS AS AUTOPHAGY INHIBITORS FOR CANCER AND OTHER THERAPY The Trustees Of The University Of Pennsylvania (US) 2021-07-14 EP disclosed
US-11001558-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2021-05-11 US disclosed
US-20050222201-A1 such as 3-(2-chloro-4-quinolinyl)-2,5-dimethyl-1H-indole-1-acetic acid, used for treating respiratory system disorders and as inhibitors of G protein-coupled receptor chemoattractant homologous receptor expressed on lymphocyte cells (CRTH2) ASTRAZENECA AB (SE) 2005-10-06 US disclosed
EP-1549634-A1 NOVEL SUBSTITUTED INDOLES AstraZeneca AB (SE) 2005-07-06 EP disclosed
WO-2004091485-A2 AMINOQUINOLINE COMPOUNDS TAIGEN BIOTECHNOLOGY (TW) 2004-10-28 WO disclosed
US-20040209902-A1 e.g., 1,4-bis[2,6-dimethylquinolin-4ylamino]butane; used to treat inflammatory and immune diseases by binding to CXCR3 receptors. TAIGEN BIOTECHNOLOGY (TW) 2004-10-21 US disclosed
WO-2003101981-A1 NOVEL SUBSTITUTED INDOLES ASTRAZENECA AB (SE) 2003-12-11 WO disclosed
US-5506235-A Quinoline derivatives as immunostimulants PFIZER INC. (US) 1996-04-09 US disclosed
EP-0387821-B1 2-Alkyl-4-arylmethylaminoquinolines, their use and medicines containing them BASF AG (DE) 1994-08-24 EP disclosed
EP-0597003-A1 QUINOLINE DERIVATIVES AS IMMUNOSTIMULANTS PFIZER INC. (US) 1994-05-18 EP disclosed
WO-1993003030-A1 QUINOLINE DERIVATIVES AS IMMUNOSTIMULANTS PFIZER INC. (US) 1993-02-18 WO disclosed
EP-0387821-A2 2-Alkyl-4-arylmethylaminoquinolines, their use and medicines containing them BASF Aktiengesellschaft (DE) 1990-09-19 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050222201-A1 such as 3-(2-chloro-4-quinolinyl)-2,5-dimethyl-1H-indole-1-acetic acid, used for treating respiratory system disorders and as inhibitors of G protein-coupled receptor chemoattractant homologous receptor expressed on lymphocyte cells (CRTH2) HRH2, HRH1, HCAR2 LMNA 4584/4885POLB 3759/4885KDM4E 4780/4885
US-11639335-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy SQSTM1, ATG7, BECN1 LMNA 1633/4885POLB 2264/4885KDM4E 1279/4885
US-20040209902-A1 e.g., 1,4-bis[2,6-dimethylquinolin-4ylamino]butane; used to treat inflammatory and immune diseases by binding to CXCR3 receptors. CXCR3, CXCL10, CXCR1 LMNA 4297/4885POLB 3281/4885KDM4E 1504/4885
US-11001558-B2 Asymmetric bisaminoquinolines and bisaminoquinolines with varied linkers as autophagy inhibitors for cancer and other therapy SQSTM1, ATG7, BECN1 LMNA 1633/4885POLB 2264/4885KDM4E 1279/4885
US-20220064118-A1 Asymmetric Bisaminoquinolines And Bisaminoquinolines With Varied Linkers As Autophagy Inhibitors For Cancer And Other Therapy SQSTM1, ATG7, BECN1 LMNA 1633/4885POLB 2264/4885KDM4E 1279/4885
US-11078185-B2 Mycobacterium tuberculosis—thioredoxin reductase inhibitor as an antitubercular agent TXNRD3, TXNRD1, TXN LMNA 3934/4885POLB 1960/4885KDM4E 1747/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.