SCHEMBL8669167

SCHEMBL8669167

Cc1oc(-c2ccccc2)nc1CCC(=O)N1C(=O)SC(Cc2ccccc2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
PPARG P37231 18/20 0.46
PPARA Q07869 16/20 0.46
CYP2C9 P11712 4/20 0.46
CYP3A4 P08684 3/20 0.46
KCNH2 Q12809 2/20 0.46
FFAR1 O14842 1/20 0.43

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
SCHEMBL8500896 0.75 KDM4E (0.46) KDM4EPPARGPPARACYP2C9CYP3A4
Darglitazone SCHEMBL37497 0.74 PPARG (0.48) KDM4EPPARGPPARACYP2C9CYP3A4
Darglitazone SCHEMBL9436449 0.74 PPARG (0.48) KDM4EPPARGPPARACYP2C9CYP3A4
Darglitazone SCHEMBL20125582 0.74 PPARG (0.48) KDM4EPPARGPPARACYP2C9CYP3A4
Darglitazone SCHEMBL243882 0.73 PPARG (0.44) KDM4EPPARGPPARACYP2C9CYP3A4
Darglitazone SCHEMBL674635 0.73 PPARG (0.48) KDM4EPPARGPPARACYP2C9CYP3A4
SCHEMBL5819389 0.73 PPARG (0.57) PPARGPPARACYP2C9CYP3A4KCNH2
SCHEMBL5798422 0.73 PPARG (0.55) PPARGPPARACYP2C9CYP3A4KCNH2
SCHEMBL6037063 0.73 MAPT (0.52) KDM4EPPARGCYP2C9CYP3A4
SCHEMBL4034559 0.72 KDM4E (0.73) KDM4EPPARGPPARAFFAR1

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
US-5753681-A INSULIN SENSITIZERS SANKYO COMPANY, LIMITED (JP) 1998-05-19 US claimed
US-5753681-A INSULIN SENSITIZERS SANKYO COMPANY, LIMITED (JP) 1998-05-19 US disclosed