SCHEMBL10593196

SCHEMBL10593196

CCCCCCC(O)CCCCCCCCCCCC=C(C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.54
FFAR4 Q5NUL3 2/20 0.54
EP300 Q09472 1/20 0.53
GPR84 Q9NQS5 8/20 0.51
FAAH O00519 4/20 0.49
NFKB1 P19838 1/20 0.45
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
PPARG P37231 1/20 0.42

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
SCHEMBL10593186 1.00 FFAR1 (0.54) FFAR1FFAR4EP300GPR84FAAH
SCHEMBL22115938 0.98 FFAR1 (0.51) FFAR1FFAR4EP300GPR84FAAH
SCHEMBL1686035 0.98 FFAR1 (0.51) FFAR1FFAR4EP300GPR84FAAH
SCHEMBL6060163 0.93 FFAR1 (0.46) FFAR1FFAR4EP300GPR84FAAH
SCHEMBL29225685 0.88 EP300 (0.42) FFAR1FFAR4EP300GPR84FAAH
SCHEMBL11676799 0.88 EP300 (0.42) FFAR1FFAR4EP300GPR84FAAH
SCHEMBL2680665 0.88 EP300 (0.42) FFAR1FFAR4EP300GPR84FAAH
SCHEMBL11676809 0.88 EP300 (0.42) FFAR1FFAR4EP300GPR84FAAH
SCHEMBL22151482 0.88 EP300 (0.67) EP300FAAHPPARDPPARG
SCHEMBL23553 0.88 EP300 (0.67) EP300FAAHPPARDPPARG

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-4833177-A MONOMERS FOR POLYURETHANES, POLYESTERS, POLYETHERS, DISPERSANTS PPG INDUSTRIES, INC. (US) 1989-05-23 US disclosed