SCHEMBL1725706

SCHEMBL1725706

CCNc1cnccc1-c1ccc(C(=O)OC)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IL2 P60568 2/20 0.47
HPGD P15428 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
AOC1 P19801 1/20 0.39
AOC3 Q16853 1/20 0.39
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
NCOA1 Q15788 2/20 0.38
NCOA3 Q9Y6Q9 2/20 0.38
LMNA P02545 1/20 0.38
PPARG P37231 1/20 0.38
NCOA2 Q15596 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2A6 P11509 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL613989 0.90 KDM6B (0.49) IL2HPGDNPSR1TSHRMAPK1
SCHEMBL1725204 0.90 MKNK1 (0.49) IL2HPGDAOC1AOC3MKNK1
SCHEMBL1724875 0.88 KDM4C (0.51) IL2HPGDNPSR1TSHRMAPK1
SCHEMBL614603 0.86 IL2 (0.49) IL2HPGDNPSR1TSHRMAPK1
SCHEMBL612008 0.85 KDM4C (0.51) IL2MKNK1MKNK2CYP3A4KDM4E
SCHEMBL1724787 0.82 IL2 (0.47) IL2HPGDNPSR1TSHRMAPK1
SCHEMBL1724418 0.80 KDM4C (0.58) IL2HPGDMKNK1MKNK2ALDH1A1
SCHEMBL613187 0.79 ALDH1A1 (0.54) IL2HPGDNPSR1TSHRMAPK1
SCHEMBL29165231 0.79 IL2 (0.47) IL2HPGDNPSR1TSHRMAPK1
SCHEMBL1726624 0.78 KDM4C (0.60) IL2HPGDMKNK1MKNK2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2403857-A1 THIENOPYRIMIDINE AS CDC7 KINASE INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2012-01-11 EP disclosed
WO-2010101302-A1 THIENOPYRIMIDINE AS CDC7 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-10 WO disclosed