SCHEMBL6685635

SCHEMBL6685635

CCOC(Cc1ccc(OC(C)C(=O)NCc2cccs2)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.49
▸ HPGD P15428 1/20 0.49
▸ MAPT P10636 1/20 0.48
▸ PPARA Q07869 10/20 0.48
▸ ALOX15 P16050 1/20 0.47
▸ PPARG P37231 6/20 0.47
▸ TSHR P16473 3/20 0.46
▸ PPARD Q03181 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL5369666 1.00 RAB9A (0.49) RAB9AHPGDMAPTPPARAALOX15
SCHEMBL5369659 1.00 RAB9A (0.49) RAB9AHPGDMAPTPPARAALOX15
SCHEMBL5361721 0.90 PPARA (0.48) RAB9AMAPTPPARAPPARGPPARD
SCHEMBL5361726 0.90 PPARA (0.48) RAB9AMAPTPPARAPPARGPPARD
SCHEMBL5359993 0.81 PPARA (0.52) PPARAPPARGPPARDALDH1A1
SCHEMBL5360001 0.81 PPARA (0.52) PPARAPPARGPPARDALDH1A1
SCHEMBL6151782 0.81 PPARA (0.55) RAB9AHPGDPPARAPPARGTSHR
SCHEMBL6151784 0.81 PPARA (0.55) RAB9AHPGDPPARAPPARGTSHR
SCHEMBL5372533 0.81 PPARA (0.59) PPARAPPARGPPARD
SCHEMBL5372523 0.81 PPARA (0.59) PPARAPPARGPPARD

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004000789-A9 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2004-03-11 — — WO claimed
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