SCHEMBL8416771

SCHEMBL8416771

CCCCC/C=C\C/C=C\C=C\C=C\C1OC1c1cccc(C(=O)OC)c1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.48
OXER1 Q8TDS5 1/20 0.40
TLR2 O60603 1/20 0.40
EPHX2 P34913 2/20 0.39
FAAH O00519 1/20 0.39

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
SCHEMBL8415851 0.94 GRM2 (0.41) ALOX5TLR2EPHX2FAAH
SCHEMBL8416769 0.94 GRM2 (0.41) ALOX5TLR2EPHX2FAAH
SCHEMBL8416773 0.94 GRM2 (0.41) ALOX5TLR2EPHX2FAAH
SCHEMBL8415827 0.94 GRM2 (0.41) ALOX5TLR2EPHX2FAAH
SCHEMBL8415832 0.94 GRM2 (0.41) ALOX5TLR2EPHX2FAAH
SCHEMBL8415858 0.93 GRM2 (0.41) ALOX5TLR2EPHX2FAAH
SCHEMBL8415854 0.93 GRM2 (0.41) ALOX5TLR2EPHX2FAAH
SCHEMBL8417247 0.88 GRM2 (0.43) TLR2EPHX2FAAH
SCHEMBL8417241 0.88 GRM2 (0.43) TLR2EPHX2FAAH
SCHEMBL8416786 0.81 ALOX5 (0.43) ALOX5TLR2EPHX2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5990326-A AN ANTIINFLAMMATORY AGENT AS INHIBITORS OF LEUKOTRIENE HYDROLASE G.D. SEARLE & CO. (US) 1999-11-23 US disclosed
EP-0360246-A1 3-Oxiranyl benzoic acids and derivatives thereof G.D. Searle & Co. (US) 1990-03-28 EP disclosed