SCHEMBL2521235

SCHEMBL2521235

CC(COc1ccc(NCc2cccc(F)c2)cc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 6/20 0.55
▸ PPARA Q07869 1/20 0.53
▸ MAOB P27338 4/20 0.48
▸ MAOA P21397 1/20 0.48
▸ SCN9A Q15858 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ PLA2G1B P04054 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ ATG4B Q9Y4P1 1/20 0.47
▸ NR4A2 P43354 1/20 0.46
▸ ADAMTS4 O75173 1/20 0.45
▸ MMP13 P45452 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
SCHEMBL2521089 0.87 FFAR1 (0.56) FFAR1PPARAMAOBKDM4EALDH1A1
SCHEMBL2517711 0.86 PPARG (0.58) FFAR1PPARAGAAMAPT
SCHEMBL2520652 0.86 FFAR1 (0.55) FFAR1PPARAMAOBMAOAADAMTS4
SCHEMBL2521232 0.85 PPARA (0.53) FFAR1PPARALMNAGAAMAPT
SCHEMBL2516528 0.81 FFAR1 (0.51) FFAR1PPARALMNAGAAMAPT
SCHEMBL2517202 0.80 FFAR1 (0.55) FFAR1MAOBMAOA
SCHEMBL2516937 0.80 FFAR1 (0.64) FFAR1PPARAGAAMAPT
SCHEMBL2514423 0.79 FFAR1 (0.53) FFAR1PPARAKDM4EALDH1A1GAA
SCHEMBL2514671 0.79 FFAR1 (0.60) FFAR1PPARAKDM4EALDH1A1LMNA
SCHEMBL2515845 0.79 MAOB (0.50) FFAR1MAOBSCN9AKDM4EALDH1A1

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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