SCHEMBL10366994

SCHEMBL10366994

Cc1cnccc1-c1sc(C(N)=O)nc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT3 Q9NTG7 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
CDK8 P49336 3/20 0.47
CCNC P24863 2/20 0.47
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
ABL1 P00519 3/20 0.39
TBK1 Q9UHD2 2/20 0.39
CHEK1 O14757 1/20 0.39
AURKA O14965 1/20 0.39
DAPK3 O43293 1/20 0.39
PRKD3 O94806 1/20 0.39
MAP4K4 O95819 1/20 0.39
PAK4 O96013 1/20 0.39
RET P07949 1/20 0.39
PIM1 P11309 1/20 0.39
FGFR1 P11362 1/20 0.39
PRKACA P17612 1/20 0.39

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
SCHEMBL10364879 0.87 EIF4E (0.41) SIRT3TDP1CDK8CCNCABL1
SCHEMBL10367445 0.86 CDK8 (0.44) SIRT3TDP1CDK8CCNCLMNA
SCHEMBL10367425 0.85 SIRT3 (0.48) SIRT3TDP1CDK8CCNCLMNA
SCHEMBL10367437 0.84 SIRT3 (0.40) SIRT3TDP1CDK8CCNCLMNA
SCHEMBL10364884 0.83 ALDH1A1 (0.40) SIRT3TDP1CDK8CCNCABL1
SCHEMBL10367006 0.83 SIRT3 (0.39) SIRT3TDP1CDK8CCNCLMNA
SCHEMBL688062 0.79 CDC7 (0.46) CDK8CCNCLMNACYP1A2CYP3A4
SCHEMBL10365276 0.73 TGFBR1 (0.47) CYP1A2ACVR1MAPT
SCHEMBL10365452 0.72 CYP3A4 (0.38) LMNACYP1A2CYP3A4CYP2C19LIMK1
SCHEMBL10365737 0.71 CYP11B1 (0.40) ABL1PRKCQCYP19A1GPBAR1LATS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0199968-B1 THIAZOLE DERIVATIVES ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 1990-02-28 EP disclosed
US-4804668-A CARDIOTONIC AGENTS ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 1989-02-14 US disclosed
EP-0199968-A1 Thiazole derivatives ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 1986-11-05 EP disclosed