SCHEMBL1697903

SCHEMBL1697903

COC(=O)c1cc2nc(Cl)cnc2s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 2/20 0.43
CSNK2B P67870 2/20 0.43
CSNK2A1 P68400 2/20 0.43
KDR P35968 1/20 0.43
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 4/20 0.38
HPGD P15428 3/20 0.38
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
PAK4 O96013 1/20 0.37
AKT1 P31749 1/20 0.37
PLK1 P53350 1/20 0.37
ABL1 P00519 1/20 0.36
BCR P11274 1/20 0.36
NPC1 O15118 2/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL1698121 0.88 CSNK2A2 (0.43) CSNK2A2CSNK2BCSNK2A1KDRKDM4E
SCHEMBL32685962 0.85 CDC7 (0.42) KDM4EALDH1A1HPGDNPC1MAPK1
SCHEMBL1697956 0.84 DAO (0.42) KDM4EALDH1A1CCNCCDK8MAPT
SCHEMBL30806799 0.75 CSNK2A2 (0.44) CSNK2A2CSNK2BCSNK2A1KDRKDM4E
SCHEMBL30799296 0.75 KDM4E (0.44) KDM4EALDH1A1HPGDCCNCCDK8
SCHEMBL24175693 0.74 CSNK2A2 (0.47) CSNK2A2CSNK2BCSNK2A1KDRKDM4E
SCHEMBL20168500 0.73 ALDH1A1 (0.47) CSNK2A2CSNK2BCSNK2A1KDRKDM4E
SCHEMBL30597783 0.73 ALDH1A1 (0.47) CSNK2A2CSNK2BCSNK2A1KDRKDM4E
SCHEMBL1697883 0.72 DAO (0.42) KDM4EALDH1A1CCNCCDK8MAPT
SCHEMBL18769953 0.72 CCNC (0.44) CSNK2A2CSNK2BCSNK2A1KDRKDM4E

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10562912-B2 Heterocyclic derivatives and use thereof C&C RESEARCH LABORATORIES (KR) 2020-02-18 US disclosed
EP-3004057-B1 HETEROCYCLIC DERIVATIVES AND THEIR USE AS STAT 3 INHIBITORS C&C RES LAB (KR) 2018-07-25 EP disclosed
US-20160108056-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RESEARCH LABORATORIES (KR) 2016-04-21 US disclosed
EP-3004057-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C Research Laboratories (KR) 2016-04-13 EP disclosed
EP-2576566-B1 THIENO(2,3B)PYRAZINE COMPOUNDS AS B-RAF INHIBITORS MERCK SHARP & DOHME (NL) 2015-10-28 EP disclosed
EP-2576566-B1 THIENO(2,3B)PYRAZINE COMPOUNDS AS B-RAF INHIBITORS MERCK SHARP & DOHME (NL) 2015-10-28 EP disclosed
WO-2014196793-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RESEARCH LABORATORIES (KR) 2014-12-11 WO disclosed
US-8669256-B2 Substituted thieno[2,3-b]pyrazine compounds as modulators of B-Raf kinase activity MERCK SHARP & DOHME B.V. (NL) 2014-03-11 US disclosed
US-8669256-B2 Substituted thieno[2,3-b]pyrazine compounds as modulators of B-Raf kinase activity MERCK SHARP & DOHME B.V. (NL) 2014-03-11 US disclosed
EP-2576566-A1 THIENO (2, 3B) PYRAZINE COMPOUNDS AS B - RAF INHIBITORS MSD Oss B.V. (NL) 2013-04-10 EP disclosed
US-20130079341-A1 THIENO (2, 3B) PYRAZINE COMPOUNDS AS B-RAF INHIBITORS ORGANON BIOSCIENCES NEDERLAND B.V. (NL) 2013-03-28 US disclosed
US-20130079341-A1 THIENO (2, 3B) PYRAZINE COMPOUNDS AS B-RAF INHIBITORS ORGANON BIOSCIENCES NEDERLAND B.V. (NL) 2013-03-28 US disclosed
US-20130079341-A1 THIENO (2, 3B) PYRAZINE COMPOUNDS AS B-RAF INHIBITORS ORGANON BIOSCIENCES NEDERLAND B.V. (NL) 2013-03-28 US disclosed
WO-2011147764-A1 THIENO (2, 3B) PYRAZINE COMPOUNDS AS B - RAF INHIBITORS N.V. ORGANON (NL) 2011-12-01 WO disclosed
WO-2011147764-A1 THIENO (2, 3B) PYRAZINE COMPOUNDS AS B - RAF INHIBITORS N.V. ORGANON (NL) 2011-12-01 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 (3 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-20160108056-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF STAT3, JAK2, STAT5A CSNK2A2 22/4885CSNK2B 37/4885CSNK2A1 18/4885
US-10562912-B2 Heterocyclic derivatives and use thereof STAT3, JAK2, STAT5A CSNK2A2 22/4885CSNK2B 37/4885CSNK2A1 18/4885
US-20130079341-A1 THIENO (2, 3B) PYRAZINE COMPOUNDS AS B-RAF INHIBITORS BRAF, RAF1, ARAF CSNK2A2 767/4885CSNK2B 618/4885CSNK2A1 824/4885

“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.