SCHEMBL1724875

SCHEMBL1724875

CCCCNc1cnccc1-c1ccc(C(=O)OC)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 5/20 0.51
KDM6B O15054 4/20 0.51
IL2 P60568 1/20 0.44
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
FAAH O00519 1/20 0.36
LIMK1 P53667 1/20 0.35
MKNK1 Q9BUB5 1/20 0.35
MKNK2 Q9HBH9 1/20 0.35
RIPK1 Q13546 1/20 0.35
NCOA1 Q15788 2/20 0.35
NCOA3 Q9Y6Q9 2/20 0.35
LMNA P02545 1/20 0.35
PPARG P37231 1/20 0.35
NCOA2 Q15596 1/20 0.35
HDAC3 O15379 2/20 0.34

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 0.93 KDM6B (0.49) KDM4CKDM6BIL2HPGDNPSR1
SCHEMBL1726624 0.91 KDM4C (0.60) KDM4CKDM6BIL2HPGDMKNK1
SCHEMBL1725706 0.88 IL2 (0.47) KDM4CKDM6BIL2HPGDNPSR1
SCHEMBL1724418 0.83 KDM4C (0.58) KDM4CKDM6BIL2HPGDLIMK1
SCHEMBL614603 0.82 IL2 (0.49) KDM4CIL2HPGDNPSR1TSHR
SCHEMBL612008 0.81 KDM4C (0.51) KDM4CKDM6BIL2FAAHMKNK1
SCHEMBL1724787 0.79 IL2 (0.47) KDM4CIL2HPGDNPSR1TSHR
SCHEMBL1725204 0.78 MKNK1 (0.49) KDM4CKDM6BIL2HPGDMKNK1
SCHEMBL613187 0.75 ALDH1A1 (0.54) KDM4CKDM6BIL2HPGDNPSR1
SCHEMBL29165231 0.75 IL2 (0.47) IL2HPGDNPSR1TSHRMAPK1

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