SCHEMBL1683773

SCHEMBL1683773

CON(C)C(=O)c1cscn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
MAP3K5 Q99683 1/20 0.35
CLK1 P49759 1/20 0.35
DYRK1A Q13627 1/20 0.35
DYRK1B Q9Y463 1/20 0.35
TRPM8 Q7Z2W7 2/20 0.35
ECE1 P42892 1/20 0.35
MLYCD O95822 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
GRM4 Q14833 2/20 0.33
ICAM1 P05362 1/20 0.32
SELE P16581 1/20 0.32
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
PIM1 P11309 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL2305835 0.81 KDM4E (0.55) KDM4EMAP3K5ECE1ALDH1A1TSHR
SCHEMBL14543239 0.75 KDM4E (0.48) KDM4EMAP3K5TRPM8ALDH1A1TSHR
SCHEMBL269086 0.73
SCHEMBL12424206 0.73 ALDH1A1 (0.50) KDM4EMAP3K5MLYCDALDH1A1TDP1
SCHEMBL30302154 0.72 KDM4E (0.46) KDM4EMAP3K5ALDH1A1TSHRRAB9A
Hydrochloric Acid SCHEMBL27395585 0.72 KDM4E (0.53) KDM4EMAP3K5ECE1ALDH1A1TSHR
SCHEMBL306106 0.71 ALDH1A1 (0.53) KDM4EALDH1A1GRM4MEN1KMT2A
SCHEMBL2311114 0.71 KDM4E (0.50) KDM4EALDH1A1TSHRMEN1KMT2A
SCHEMBL30302167 0.71 KDM4E (0.44) KDM4EMAP3K5ALDH1A1TSHRMEN1
Ethyne SCHEMBL27709832 0.70 KDM4E (0.52) KDM4EMAP3K5ECE1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220389002-A1 Chiral Indole Compounds and Their Use ARIAGEN, INC. (US) 2022-12-08 US disclosed
EP-3289876-B1 COMPOUNDS FOR TREATMENT OF CANCER UNIV TENNESSEE RES FOUND (US) 2022-07-20 EP disclosed
US-11390621-B2 Chiral indole compounds and their use ARIAGEN, INC. (US) 2022-07-19 US disclosed
EP-3956327-A1 CHIRAL INDOLE COMPOUNDS AND THEIR USE Ariagen, Inc. (US) 2022-02-23 EP disclosed
CN-113906021-A Chiral indole compound and application thereof 阿里根公司 2022-01-07 CN disclosed
US-20210188834-A1 Chiral Indole Compounds and Their Use ARIAGEN, INC. (US) 2021-06-24 US disclosed
US-10865196-B2 Compounds for treatment of cancer UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2020-12-15 US disclosed
WO-2020214740-A9 CHIRAL INDOLE COMPOUNDS AND THEIR USE ARIAGEN, INC. (US) 2020-11-26 WO disclosed
WO-2020214740-A1 CHIRAL INDOLE COMPOUNDS AND THEIR USE ARIAGEN, INC. (US) 2020-10-22 WO disclosed
US-10301285-B2 Compounds for treatment of cancer GTX, INC. (US) 2019-05-28 US disclosed
US-8071595-B2 1,2-disubstituted heterocyclic compounds ENVIVO PHARMACEUTICALS, INC. (US) 2011-12-06 US disclosed
EP-2303021-A2 COMPOUNDS FOR THE TREATMENT OF CANCER University of Tennessee Research Foundation (US) 2011-04-06 EP disclosed
WO-2010074776-A2 COMPOUNDS FOR THE TREATMENT OF CANCER THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2010-07-01 WO disclosed
US-20100137317-A1 1,2-Disubstituted Heterocyclic Compounds ENVIVO PHARMACEUTICALS, INC. (US) 2010-06-03 US disclosed
US-20090326020-A1 COMPOUNDS FOR TREATMENT OF CANCER UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2009-12-31 US disclosed
US-20090326020-A1 COMPOUNDS FOR TREATMENT OF CANCER UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2009-12-31 US disclosed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US disclosed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US disclosed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US disclosed
WO-2008004117-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER PRODUCTS INC. (US) 2008-01-10 WO 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 (8 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-20090326020-A1 COMPOUNDS FOR TREATMENT OF CANCER HCCS, NQO1, CCNY KDM4E 1473/4885MAP3K5 4294/4885CLK1 3874/4885
US-10865196-B2 Compounds for treatment of cancer CYP19A1, CYP17A1, SOX18 KDM4E 260/4885MAP3K5 1679/4885CLK1 4521/4885
US-10301285-B2 Compounds for treatment of cancer CYP19A1, CYP17A1, SOX18 KDM4E 260/4885MAP3K5 1679/4885CLK1 4521/4885
US-20210188834-A1 Chiral Indole Compounds and Their Use IDO1, IDO2, INMT KDM4E 1410/4885MAP3K5 2197/4885CLK1 1593/4885
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PDE5A, PDE3B, PDE12 KDM4E 636/4885MAP3K5 892/4885CLK1 2394/4885
US-20220389002-A1 Chiral Indole Compounds and Their Use IDO1, IDO2, INMT KDM4E 1410/4885MAP3K5 2197/4885CLK1 1593/4885
US-11390621-B2 Chiral indole compounds and their use IDO1, IDO2, INMT KDM4E 1410/4885MAP3K5 2197/4885CLK1 1593/4885
US-20100137317-A1 1,2-Disubstituted Heterocyclic Compounds PDE12, PDE7A, PDE10A KDM4E 1865/4885MAP3K5 1388/4885CLK1 1969/4885

“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.