SCHEMBL7479986

SCHEMBL7479986

O=C(O)CCc1ccc(NC(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 12/20 0.60
FFAR4 Q5NUL3 2/20 0.59
NR1H4 Q96RI1 1/20 0.58
KEAP1 Q14145 1/20 0.57
POLB P06746 1/20 0.55
ALDH1A1 P00352 1/20 0.54
EPHX2 P34913 1/20 0.54
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.52
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50

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
SCHEMBL15295162 0.89 SMN1; SMN2 (0.60) FFAR1NR1H4POLBALDH1A1EPHX2
SCHEMBL29092627 0.87 POLB (0.50) POLBALDH1A1MAPTHTT
SCHEMBL659263 0.85 NR1H4 (0.59) FFAR1FFAR4NR1H4KEAP1ALDH1A1
SCHEMBL5652618 0.83 FFAR1 (0.63) FFAR1FFAR4NR1H4KEAP1ALDH1A1
SCHEMBL69746 0.82 FFAR1 (0.81) FFAR1FFAR4KEAP1CA1CA2
SCHEMBL4109710 0.82 FFAR1 (0.53) FFAR1FFAR4NR1H4KEAP1POLB
SCHEMBL7328828 0.82 POLB (0.53) FFAR1FFAR4NR1H4KEAP1POLB
SCHEMBL27906215 0.82 EPHX2 (0.56) FFAR1FFAR4NR1H4KEAP1POLB
SCHEMBL5789 0.82 CYP4F2 (0.48) POLBMAPTHTTCA2
SCHEMBL5619 0.82 POLB (0.46) POLBALDH1A1MAPTHTT

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
EP-1229010-A1 NOVEL DIARYLAMIDE DERIVATIVES AND USE THEREOF AS MEDICINES Japan Energy Corporation (JP) 2002-08-07 EP disclosed