SCHEMBL2516937

SCHEMBL2516937

CC(COc1ccc(NCc2ccc(Oc3ccccc3)cc2)cc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 10/20 0.64
▸ FFAR4 Q5NUL3 2/20 0.60
▸ CACNA1B Q00975 3/20 0.56
▸ PPARG P37231 2/20 0.50
▸ PPARA Q07869 2/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ TP53 P04637 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ BLM P54132 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ GNA15 P30679 1/20 0.49
▸ PTGER3 P43115 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49

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 0.92 PPARG (0.58) FFAR1FFAR4PPARGPPARAMEN1
SCHEMBL2514671 0.87 FFAR1 (0.60) FFAR1PPARGPPARAMEN1TP53
SCHEMBL2514423 0.87 FFAR1 (0.53) FFAR1PPARGPPARAMEN1TP53
SCHEMBL2521232 0.86 PPARA (0.53) FFAR1CACNA1BPPARGPPARAMEN1
SCHEMBL2514000 0.86 FFAR1 (0.52) FFAR1PPARGPPARAMEN1TP53
SCHEMBL2516528 0.81 FFAR1 (0.51) FFAR1PPARGPPARAMEN1TP53
SCHEMBL2517202 0.81 FFAR1 (0.55) FFAR1
SCHEMBL2521089 0.81 FFAR1 (0.56) FFAR1PPARGPPARAMEN1GAA
SCHEMBL2520652 0.80 FFAR1 (0.55) FFAR1PPARGPPARAMEN1KMT2A
SCHEMBL2521235 0.80 FFAR1 (0.55) FFAR1PPARAGAAMAPT

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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