SCHEMBL161331

SCHEMBL161331

NC(=O)c1cccc(Cl)c1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 5/20 0.49
LMNA P02545 1/20 0.49
KMT2A Q03164 3/20 0.47
ATM Q13315 1/20 0.47
TSHR P16473 2/20 0.47
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HPGD P15428 2/20 0.45
MAPT P10636 2/20 0.45
HSD17B10 Q99714 1/20 0.45
MEN1 O00255 2/20 0.44
NPC1 O15118 1/20 0.44
CASP3 P42574 1/20 0.44
RAB9A P51151 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
PARP1 P09874 2/20 0.43
PBRM1 Q86U86 1/20 0.43
POLB P06746 1/20 0.42

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
SCHEMBL40536 0.84 ALDH1A1 (0.54) KDM4EALDH1A1KMT2ATSHRHPGD
SCHEMBL4096953 0.83 ALDH1A1 (0.52) KDM4EALDH1A1LMNAKMT2ATSHR
SCHEMBL146560 0.83 TSHR (0.63) KDM4EALDH1A1LMNAKMT2ATSHR
SCHEMBL1189439 0.81 TSHR (0.45) KDM4EALDH1A1LMNAKMT2ATSHR
SCHEMBL112377 0.80 TSHR (0.65) KDM4EALDH1A1LMNAKMT2AATM
SCHEMBL29787113 0.80 TSHR (0.65) KDM4EALDH1A1LMNAKMT2AATM
SCHEMBL29843413 0.79 CES2 (0.65) KDM4EALDH1A1LMNAKMT2AATM
SCHEMBL263770 0.79 CES2 (0.65) KDM4EALDH1A1LMNAKMT2AATM
SCHEMBL4878766 0.78 TSHR (0.63) KDM4EALDH1A1LMNAKMT2AATM
SCHEMBL11825925 0.78 PKM (0.39) KDM4EALDH1A1LMNAKMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3931317-A FUNGICIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-01-06 US claimed
EP-2408454-B1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP (CA) 2024-07-24 EP disclosed
US-11993585-B2 Poly-ADP ribose polymerase (PARP) inhibitors MITOBRIDGE, INC. (US) 2024-05-28 US disclosed
EP-3964509-B1 COMPOUND CONTAINING FUSED RING, USE THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME NANJING HEPO PHARMACEUTICAL CO LTD (CN) 2023-06-14 EP disclosed
US-11661420-B2 Compound containing fused ring, use thereof and pharmaceutical composition containing same NANJING HEPO PHARMACEUTICAL CO., LTD (CN) 2023-05-30 US disclosed
US-11661420-B2 Compound containing fused ring, use thereof and pharmaceutical composition containing same NANJING HEPO PHARMACEUTICAL CO., LTD (CN) 2023-05-30 US disclosed
CN-110167926-B Poly-ADP ribose polymerase (PARP) inhibitors 米托布里奇公司 2022-09-13 CN disclosed
US-11407719-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2022-08-09 US disclosed
US-20220213085-A1 COMPOUND CONTAINING FUSED RING, USE THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME NANJING HEPO PHARMACEUTICAL CO., LTD (CN) 2022-07-07 US disclosed
US-20220033380-A1 POLY-ADP RIBOSE POLYMERASE (PARP) INHIBITORS Astellas Engineered Small Molecules US, Incorporated 2022-02-03 US disclosed
CN-101460490-A Substituted ring fused azines and their use in cancer therapy AUCKLAND UNISERVICES LTD (NZ) 2009-06-17 CN disclosed
WO-2008157500-A1 AMINOQUINAZOLINE CANNABINOID RECEPTOR MODULATORS FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2008-12-24 WO disclosed
US-20040176361-A1 Fused heterocyclic compound and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2004-09-09 US disclosed
EP-1396488-A1 FUSED HETEROCYCLIC COMPOUND AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2004-03-10 EP disclosed
EP-0263523-B1 Process for the preparation of thiazolo [2,3-b] quinazolones BASF AG (DE) 1993-12-29 EP disclosed
US-5030727-A Reacting an anthronilide derivative with a thiazole derivative or a fluorozuinazolone with a neucleophile BASF AKTIENGESELLSCHAFT (DE) 1991-07-09 US disclosed
EP-0263523-A2 Process for the preparation of thiazolo [2,3-b] quinazolones BASF Aktiengesellschaft (DE) 1988-04-13 EP disclosed
US-4400507-A FOR COLORING POLYMERS, LACQUERS CIBA-GEIGY CORPORATION (US) 1983-08-23 US disclosed
US-4262120-A YELLOW TO ORANGE SHADES OF GOOD FASTNESS CIBA-GEIGY CORPORATION (US) 1981-04-14 US disclosed
US-3931317-A FUNGICIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-01-06 US 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-20220033380-A1 POLY-ADP RIBOSE POLYMERASE (PARP) INHIBITORS PARP1, PARP2, PARP11 KDM4E 2486/4885ALDH1A1 203/4885LMNA 172/4885
US-11407719-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 KDM4E 3982/4885ALDH1A1 587/4885LMNA 3612/4885
US-11993585-B2 Poly-ADP ribose polymerase (PARP) inhibitors PARP1, PARP2, PARP11 KDM4E 2486/4885ALDH1A1 203/4885LMNA 172/4885
US-20040176361-A1 Fused heterocyclic compound and medicinal use thereof PARP11, PARP1, CD38 KDM4E 2586/4885ALDH1A1 65/4885LMNA 1348/4885
US-20220213085-A1 COMPOUND CONTAINING FUSED RING, USE THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME HLA-B, HLA-A, SLC10A1 KDM4E 2312/4885ALDH1A1 2801/4885LMNA 320/4885
US-11661420-B2 Compound containing fused ring, use thereof and pharmaceutical composition containing same HLA-B, HLA-A, SLC10A1 KDM4E 2312/4885ALDH1A1 2801/4885LMNA 320/4885

“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.