SCHEMBL7810674

SCHEMBL7810674

CCC(O)(c1cc(O)cc(F)c1)c1nccs1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 17/20 0.51
▸ SRC P12931 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ ZAP70 P43403 1/20 0.33
▸ SYK P43405 1/20 0.33
▸ AR P10275 1/20 0.32

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
SCHEMBL7810589 0.85 ALOX5 (0.47) ALOX5AR
SCHEMBL9433229 0.81 ALOX5 (0.61) ALOX5
SCHEMBL7813254 0.80 ALOX5 (0.60) ALOX5
SCHEMBL7809281 0.79 ALOX5 (0.63) ALOX5
SCHEMBL9597758 0.76 ALOX5 (0.75) ALOX5
SCHEMBL7809275 0.69 ALOX5 (0.47) ALOX5
SCHEMBL7809252 0.69 KCNH2 (0.36) ALOX5AR
SCHEMBL9369848 0.69 ALOX5 (0.55) ALOX5
SCHEMBL7810732 0.69 ALOX5 (0.64) ALOX5
SCHEMBL7812830 0.69 CA12 (0.46) ALOX5AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0788497-B1 BISARYLCARBINOL DERIVATIVES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS MERCK FROSST CANADA INC (CA) 2001-05-23 — — EP disclosed
EP-0788490-B1 BISARYLCARBINOL CINNAMIC ACIDS AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS MERCK FROSST CANADA INC (CA) 2000-07-05 — — EP disclosed
US-5552437-A ANTIASTHMATIC, ANTIALLERGIC, ANTIINFLAMMATORY, AND CYTOPROTECTIVE AGENTS MERCK FROSST CANADA, INC. (CA) 1996-09-03 — — US disclosed
US-5527827-A ANTIASTHMATIC, ANTIALLERGIC, ANTIINFLAMMATORY AND CYTOPROTECTIVE AGENTS MERCK FROSST CANADA, INC. (CA) 1996-06-18 — — US disclosed
WO-1996013500-A1 BISARYLCARBINOL DERIVATIVES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS MERCK FROSST CANADA INC. (CA) 1996-05-09 — — WO disclosed
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