SCHEMBL30002423

SCHEMBL30002423

COc1cc(F)c(NC(=O)c2ccccc2C(=O)O)cc1S(=O)(=O)n1ccc2c(F)cccc21

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 6/20 0.59
PPARG P37231 6/20 0.49
PPARD Q03181 6/20 0.49
PPARA Q07869 6/20 0.49
KMT2A Q03164 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
GAA P10253 1/20 0.43
HTR6 P50406 3/20 0.43
MEN1 O00255 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL28892358 1.00 FABP4 (0.59) FABP4PPARGPPARDPPARAKMT2A
SCHEMBL28892270 0.89 FABP4 (0.50) FABP4PPARGPPARDPPARAKMT2A
SCHEMBL28892372 0.86 PPARG (0.49) FABP4PPARGPPARDPPARAKMT2A
SCHEMBL28892694 0.85 FABP4 (0.52) FABP4PPARGPPARDPPARAKMT2A
SCHEMBL28892197 0.83 PPARG (0.51) FABP4PPARGPPARDPPARAKMT2A
SCHEMBL30002444 0.83 PPARG (0.51) FABP4PPARGPPARDPPARAKMT2A
SCHEMBL28892614 0.79 FABP4 (0.48) FABP4PPARGPPARDPPARAKMT2A
SCHEMBL28892612 0.76 FABP4 (0.45) FABP4PPARGPPARDPPARAKMT2A
SCHEMBL30002435 0.75 HTR6 (0.53) FABP4HTR6
SCHEMBL28959478 0.72 HTR6 (0.49) FABP4KMT2AHTR6MEN1ALDH1A1

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-115232144-B Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof 长春金赛药业有限责任公司 2024-04-02 CN disclosed
CN-115232144-A Nitrogen-containing fused ring derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-10-25 CN disclosed