SCHEMBL9536665

SCHEMBL9536665

CN(CCOc1ccc(CC2NC(=O)SC2=O)cc1)C(=O)OCCc1ccccc1.[NaH]

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 3/20 0.40
LTB4R2 Q9NPC1 3/20 0.40
PPARG P37231 5/20 0.40
RARG P13631 1/20 0.40
RXRA P19793 1/20 0.40
FFAR1 O14842 1/20 0.38
LTA4H P09960 2/20 0.38
HRH3 Q9Y5N1 1/20 0.38
HPGD P15428 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 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
SCHEMBL9532314 0.99 LTB4R (0.41) LTB4RLTB4R2PPARGRARGRXRA
SCHEMBL9536508 0.91 ITGB3 (0.44) LTB4RLTB4R2PPARGRARGRXRA
SCHEMBL9123920 0.87 LTB4R (0.46) LTB4RLTB4R2PPARGRARGRXRA
SCHEMBL9535011 0.87 PPARG (0.42) LTB4RLTB4R2PPARGRARGRXRA
SCHEMBL9121904 0.85 MAPT (0.43) PPARGRARGRXRALTA4HHRH3
SCHEMBL9536662 0.83 PPARG (0.59) PPARGRARGRXRAFFAR1
SCHEMBL9532301 0.82 PPARG (0.60) PPARGRARGRXRAFFAR1
SCHEMBL10468305 0.81 NPY5R (0.44) PPARGRARGRXRALTA4HHRH3
SCHEMBL9325005 0.79 PPARG (0.48) PPARGRARGRXRAFFAR1LTA4H
SCHEMBL9326656 0.77 HRH3 (0.48) PPARGFFAR1HRH3HPGD

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-0555251-A1 THIAZOLIDINE DIONE DERIVATIVES BEECHAM GROUP plc (GB) 1993-08-18 EP claimed
WO-1992007838-A1 THIAZOLIDINE DIONE DERIVATIVES BEECHAM GROUP PLC (GB) 1992-05-14 WO claimed