SCHEMBL9707330

SCHEMBL9707330

CC(=O)N(O)CC=Cc1ccc(F)c(Oc2ccccc2)c1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.69
PTGS1 P23219 2/20 0.69
PTGS2 P35354 2/20 0.69
ALOX5AP P20292 1/20 0.69
EPOR P19235 4/20 0.46
TSPO P30536 5/20 0.39
BACE1 P56817 3/20 0.38
TTR P02766 1/20 0.38
IDO1 P14902 1/20 0.37
TDO2 P48775 1/20 0.37
LPAR1 Q92633 1/20 0.37
LPAR5 Q9H1C0 1/20 0.37

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
SCHEMBL9877137 0.89 ALOX5 (0.54) ALOX5PTGS1PTGS2ALOX5APEPOR
SCHEMBL9877132 0.89 ALOX5 (0.54) ALOX5PTGS1PTGS2ALOX5APEPOR
SCHEMBL9877185 0.86 ALOX5 (0.51) ALOX5PTGS1PTGS2ALOX5APEPOR
SCHEMBL9877184 0.86 ALOX5 (0.51) ALOX5PTGS1PTGS2ALOX5APEPOR
SCHEMBL9877323 0.85 ALOX5 (0.50) ALOX5PTGS1PTGS2ALOX5APEPOR
SCHEMBL9877324 0.85 ALOX5 (0.50) ALOX5PTGS1PTGS2ALOX5APEPOR
SCHEMBL3899072 0.82 ALOX5 (1.00) ALOX5PTGS1PTGS2ALOX5APEPOR
SCHEMBL29808733 0.82 ALOX5 (1.00) ALOX5PTGS1PTGS2ALOX5APEPOR
SCHEMBL3903195 0.82 ALOX5 (1.00) ALOX5PTGS1PTGS2ALOX5APEPOR
SCHEMBL9877152 0.80 ALOX5 (0.45) ALOX5PTGS1PTGS2ALOX5APEPOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0196184-B1 ARYL DERIVATIVES THE WELLCOME FOUNDATION LIMITED (GB) 1992-09-16 EP disclosed
US-5036157-A Hydroxamic acid derivatives, lipoxygenase and cyclooxygenase inhibitors, anticoagulants, antiinflammatory agents BURROUGHS WELLCOME CO. 1991-07-30 US disclosed
US-4977188-A Hydroamic acid derivatives BURROUGHS WELLCOME CO. (US) 1990-12-11 US disclosed
WO-1990001929-A1 NEW MEDICAL USE THE WELLCOME FOUNDATION LIMITED (GB) 1990-03-08 WO disclosed
US-4738986-A CYCLOOXYGENASE, LIDOXYGENASE INHIBITORS BURROUGHS WELLCOME CO. (US) 1988-04-19 US disclosed
EP-0196184-A2 Aryl derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1986-10-01 EP disclosed