SCHEMBL11092071

SCHEMBL11092071

CCCCCCCC[C@H]1CCC[C@@H]1CCCC(O)C(O)=C(O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.42
FFAR1 O14842 1/20 0.42
ALOX5 P09917 1/20 0.41
PTGER2 P43116 5/20 0.37
TBXA2R P21731 1/20 0.37
PTGFR P43088 1/20 0.37
MAPT P10636 1/20 0.34
BCHE P06276 1/20 0.34
ALDH1A1 P00352 1/20 0.34
FFAR4 Q5NUL3 1/20 0.33
PTGER4 P35408 1/20 0.33
PTGER3 P43115 1/20 0.33

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
SCHEMBL11516206 0.84 ALOX5 (0.38) GPR84FFAR1ALOX5FFAR4
SCHEMBL11656327 0.83 GPR84 (0.49) GPR84FFAR1ALOX5PTGER2TBXA2R
SCHEMBL11541198 0.82 GPR84 (0.66) GPR84FFAR1ALOX5PTGER2TBXA2R
SCHEMBL1506633 0.80 GPR84 (0.64) GPR84FFAR1MAPTFFAR4
SCHEMBL1506632 0.80 GPR84 (0.64) GPR84FFAR1MAPTFFAR4
SCHEMBL5436849 0.74 ACE2 (0.56) GPR84FFAR1ALOX5PTGER2TBXA2R
SCHEMBL8199605 0.73 FFAR4 (0.59) GPR84FFAR1ALOX5PTGER2TBXA2R
SCHEMBL29559353 0.73 EPHX1 (0.48) ALOX5ALDH1A1
SCHEMBL28380195 0.73 EPHX1 (0.48) ALOX5ALDH1A1
SCHEMBL29385123 0.73 EPHX1 (0.48) ALOX5ALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4489092-A Prostanoic acid derivatives and their preparation SCHERING AKTIENGESELLSCHAFT (DE) 1984-12-18 US disclosed
US-4359467-A Prostanoic acid derivatives and their preparation SCHERING AKTIENGESELLSCHAFT (DE) 1982-11-16 US disclosed
US-4284646-A Prostanoic acid derivatives and their preparation SCHERING AKTIENGESELLSCHAFT (DE) 1981-08-18 US disclosed