SCHEMBL8429668

SCHEMBL8429668

CN(CCOc1ccccc1C=O)c1nc2ccccc2o1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.53
PPARA Q07869 2/20 0.50
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL8716289 0.94 PPARG (0.48) PPARGPPARAALDH1A1HPGDHTT
SCHEMBL8716282 0.93 PPARG (0.47) PPARGPPARAALDH1A1HPGDHTT
SCHEMBL7830197 0.86 PPARG (0.57) PPARGPPARA
SCHEMBL4744468 0.82 PPARG (0.63) PPARGPPARA
SCHEMBL8719648 0.82 ALDH1A1 (0.48) PPARGALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL7826285 0.79 PPARG (0.68) PPARGPPARA
SCHEMBL14188640 0.78 PPARG (0.57) PPARGPPARA
SCHEMBL8431283 0.77 PPARG (0.50) PPARGPPARA
SCHEMBL6802249 0.77 PPARG (0.57) PPARGPPARA
SCHEMBL8716801 0.76 NPC1 (0.47) PPARGPPARAALDH1A1SMN1; SMN2

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-5869495-A TREATMENT AND/OR PROPHYLAXIS OF HYPERGLYCAEMIA SMITHKLINE BEECHAM P.L.C. (GB) 1999-02-09 US disclosed
US-5756525-A USING A THIAZOLIDINEDIONE COMPOUND BEECHAM GROUP PLC (GB) 1998-05-26 US disclosed