SCHEMBL2521089

SCHEMBL2521089

Cc1cccc(CNc2ccc(OCC(C)C(=O)O)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 9/20 0.56
▸ GFER P55789 1/20 0.47
▸ HIF1A Q16665 1/20 0.46
▸ PPARG P37231 1/20 0.45
▸ PPARA Q07869 1/20 0.45
▸ MAOB P27338 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ NR1H4 Q96RI1 1/20 0.43
▸ HTT P42858 1/20 0.43

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
SCHEMBL2517711 0.87 PPARG (0.58) FFAR1HIF1APPARGPPARAMEN1
SCHEMBL2520652 0.87 FFAR1 (0.55) FFAR1HIF1APPARGPPARAMAOB
SCHEMBL2521235 0.87 FFAR1 (0.55) FFAR1PPARAMAOBKDM4EALDH1A1
SCHEMBL2514423 0.85 FFAR1 (0.53) FFAR1HIF1APPARGPPARAKDM4E
SCHEMBL2516528 0.84 FFAR1 (0.51) FFAR1HIF1APPARGPPARAMEN1
SCHEMBL2517202 0.81 FFAR1 (0.55) FFAR1MAOB
SCHEMBL2516937 0.81 FFAR1 (0.64) FFAR1HIF1APPARGPPARAMEN1
SCHEMBL2514671 0.80 FFAR1 (0.60) FFAR1HIF1APPARGPPARAKDM4E
SCHEMBL2514000 0.79 FFAR1 (0.52) FFAR1HIF1APPARGPPARAMEN1
SCHEMBL2521232 0.79 PPARA (0.53) FFAR1HIF1APPARGPPARAMEN1

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
US-8034966-B1 Phenoxyisobutyric acid compounds and methods for synthesis Cell Viable Corporation (US) 2011-10-11 — — US disclosed
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