SCHEMBL10779094

SCHEMBL10779094

CCCCCCCCCCC(C(=O)O)[C@@H](O)CCl

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.55
FFAR1 O14842 2/20 0.55
MAPT P10636 1/20 0.48
LCK P06239 1/20 0.48
PPARD Q03181 1/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48
FFAR4 Q5NUL3 1/20 0.46
ACE2 Q9BYF1 1/20 0.46
GRIK1 P39086 1/20 0.42
GRIK2 Q13002 1/20 0.42
SPHK1 Q9NYA1 1/20 0.41
FAAH O00519 1/20 0.41
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL10780894 1.00 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL10778032 1.00 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL10778036 1.00 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL10774542 1.00 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL6241100 0.92 CA2 (0.45) GPR84FFAR1MAPTLCKPPARD
SCHEMBL10778924 0.92 CA2 (0.45) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5054302 0.86 GPR84 (0.61) GPR84FFAR1MAPTLCKPPARD
SCHEMBL21679654 0.86 GPR84 (0.61) GPR84FFAR1MAPTLCKPPARD
SCHEMBL21679674 0.86 GPR84 (0.61) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8917383 0.86 GPR84 (0.61) GPR84FFAR1MAPTLCKPPARD

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-4710468-A FROM OPTICALLY ACTIVE SUBSTITUTED HYDROXYBUTYRIC ACID DERIVATIVES WITH OXIDOREDUCTASE SIGMA-TAU INDUSTRIE PHARMACEUTICHE RIUNITE S.P.A. (IT) 1987-12-01 US disclosed