SCHEMBL9047280

SCHEMBL9047280

COC1(c2cc(F)cc(Sc3ccc(C(=O)c4ccccc4)cc3)c2)CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 15/20 0.46
PTGS1 P23219 7/20 0.41
PTGS2 P35354 6/20 0.41
HPGD P15428 2/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL9440397 0.92 ALOX5 (0.46) ALOX5
SCHEMBL9049483 0.88 ALOX5 (0.51) ALOX5HPGD
SCHEMBL9049009 0.88 ALOX5 (0.41) ALOX5PTGS1PTGS2
SCHEMBL9440209 0.86 ALOX5 (0.43) ALOX5HPGD
SCHEMBL9045791 0.85 ALOX5 (0.46) ALOX5
SCHEMBL9074195 0.85 ALOX5 (0.46) ALOX5
SCHEMBL9073667 0.85 ALOX5 (0.46) ALOX5
SCHEMBL9048169 0.85 ALOX5 (0.46) ALOX5PTGS1
SCHEMBL9049108 0.84 ALOX5 (0.46) ALOX5
SCHEMBL9440369 0.84 ALOX5 (0.45) ALOX5HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0555068-B1 Oxime derivatives as 5-lipoxygenase inhibitors ZENECA LTD (GB) 1996-04-10 EP disclosed
US-5482966-A LIPOXYGENASE ENZYME INHIBITORS AS ANTIINFLAMMATORY AGENTS ZENECA LIMITED (GB) 1996-01-09 US disclosed
US-5332757-A Enzyme inhibitors ZENECA LIMITED (GB) 1994-07-26 US disclosed
EP-0555068-A1 Oxime derivatives as 5-lipoxygenase inhibitors ZENECA LIMITED (GB) 1993-08-11 EP disclosed