SCHEMBL9245437

SCHEMBL9245437

Cc1oc(-c2scc3ccccc23)nc1CCOc1ccc(CC2NC(=O)SC2=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.46
PPARA Q07869 15/20 0.46
CYP2C9 P11712 3/20 0.42
CYP3A4 P08684 2/20 0.42
KCNH2 Q12809 2/20 0.42
PPARD Q03181 3/20 0.41

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
SCHEMBL6052101 0.85 PPARG (0.61) PPARGPPARACYP2C9CYP3A4KCNH2
SCHEMBL9245425 0.85 PPARG (0.49) PPARGPPARACYP3A4
SCHEMBL5918535 0.84 PPARG (0.44) PPARGPPARACYP2C9CYP3A4KCNH2
SCHEMBL9411863 0.79 PPARG (0.47) PPARGPPARACYP2C9CYP3A4KCNH2
SCHEMBL9411875 0.78 PPARG (0.47) PPARGPPARACYP2C9CYP3A4KCNH2
SCHEMBL6960218 0.78 PPARG (0.57) PPARGPPARAPPARD
SCHEMBL9411826 0.77 PPARG (0.43) PPARGPPARACYP2C9CYP3A4KCNH2
SCHEMBL9411839 0.77 PPARG (0.43) PPARGPPARACYP2C9CYP3A4KCNH2
SCHEMBL9411929 0.77 PPARG (0.41) PPARGPPARACYP2C9CYP3A4KCNH2
SCHEMBL8030739 0.76 PPARG (0.59) PPARGPPARACYP2C9CYP3A4KCNH2

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
JP-7188227-A None JP disclosed
JP-H07188227-A THIAZOLIDINE DERIVATIVE AND OXAZOLE DERIVATIVE JAPAN TOBACCO INC 1995-07-25 JP disclosed