SCHEMBL9048778

SCHEMBL9048778

COC1(c2nccs2)CCOCC1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 12/20 0.34
F2RL3 Q96RI0 1/20 0.32
OPRL1 P41146 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
BACE1 P56817 1/20 0.31

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
SCHEMBL12133606 0.84 ALOX5 (0.34) ALOX5OPRL1NPC1RAB9ABACE1
SCHEMBL9049881 0.74 OPRL1 (0.49) ALOX5OPRL1BACE1
SCHEMBL9051158 0.71 F2RL3 (0.35) ALOX5F2RL3
SCHEMBL12133618 0.69 CNR2 (0.39) OPRL1BACE1
SCHEMBL9048558 0.69 BACE1 (0.36) ALOX5BACE1
SCHEMBL25933403 0.68 F2RL3 (0.44) ALOX5F2RL3
SCHEMBL15349023 0.68 F2RL3 (0.41) ALOX5F2RL3
SCHEMBL1357154 0.68 ALOX5 (0.32) ALOX5OPRL1
SCHEMBL19508120 0.66 ALOX15 (0.36) OPRL1BACE1
SCHEMBL9126495 0.66 ALOX5 (0.33) ALOX5

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