SCHEMBL15418005

SCHEMBL15418005

CCCCCC(=O)C(Cc1ccc(-c2ccccc2C#N)nc1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.40
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
BRS3 P32247 8/20 0.37
AGTR1 P30556 1/20 0.37
AGTR2 P50052 1/20 0.37
TSHR P16473 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
MME P08473 1/20 0.36
FFAR1 O14842 1/20 0.36

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
SCHEMBL11897519 0.97 TSHR (0.40) FAAHNPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL15418090 0.93 PRKDC (0.39) FAAHNPC1RAB9ASMN1; SMN2BRS3
SCHEMBL15418062 0.90 TSHR (0.36) FAAHSMN1; SMN2BRS3AGTR1AGTR2
SCHEMBL15418015 0.88 BRS3 (0.40) FAAHBRS3MMEFFAR1AKR1B1
SCHEMBL1370921 0.87 TSHR (0.39) FAAHSMN1; SMN2BRS3TSHRALDH1A1
SCHEMBL9710320 0.84 MME (0.51) BRS3AGTR1AGTR2TSHRMME
SCHEMBL9710577 0.83 MME (0.50) BRS3AGTR1AGTR2TSHRMME
SCHEMBL9710219 0.83 MME (0.50) BRS3AGTR1AGTR2TSHRMME
SCHEMBL1374077 0.83 MAPT (0.39) SMN1; SMN2BRS3KDM4EALDH1A1HPGD
SCHEMBL16457755 0.83 PRKDC (0.37) FAAHBRS3TSHRALDH1A1HPGD

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-2687523-A1 NOVEL PHENYLPYRIDINE DERIVATIVE AND DRUG CONTAINING SAME Kowa Company Ltd. (JP) 2014-01-22 EP disclosed