SCHEMBL8811053

SCHEMBL8811053

O=C1NC(=O)C(Cc2cccc3c2ccn3C(c2ccccc2)c2ccccc2)S1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 12/20 0.42
PPARG P37231 6/20 0.41
MAPT P10636 2/20 0.37
CA2 P00918 1/20 0.37
MAPK1 P28482 1/20 0.36
PPARA Q07869 3/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL8810504 0.89 FFAR1 (0.41) FFAR1PPARGMAPTCA2MAPK1
SCHEMBL8810461 0.87 FFAR1 (0.44) FFAR1PPARGMAPTCA2PPARA
SCHEMBL8812828 0.86 FFAR1 (0.39) FFAR1PPARGMAPTCA2PPARA
SCHEMBL8811280 0.83 FFAR1 (0.42) FFAR1PPARGMAPTCA2MAPK1
SCHEMBL8687694 0.81 FFAR1 (0.41) FFAR1PPARGMAPTCA2MAPK1
SCHEMBL8813771 0.81 FFAR1 (0.41) FFAR1PPARGMAPTCA2MAPK1
SCHEMBL8810906 0.81 FFAR1 (0.41) FFAR1PPARGMAPTCA2MAPK1
SCHEMBL8685380 0.79 CA2 (0.43) FFAR1PPARGMAPTCA2PPARA
SCHEMBL8685830 0.79 PPARG (0.47) FFAR1PPARGMAPTCA2MAPK1
SCHEMBL8686495 0.79 PPARG (0.44) FFAR1PPARGMAPTCA2MAPK1

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
CN-1167111-A Thiazolidinedione derivatives, method for preparing derivatives and pharmaceutical compositions containing same SENGA PHARMACEUTICAL LAB INC (JP) 1997-12-10 CN disclosed
EP-0780389-A1 Thiazolidinedione derivatives, process for their preparation and pharmaceutical compositions containing them TOBISHI PHARMACEUTICAL CO., LTD. (JP) 1997-06-25 EP disclosed