SCHEMBL9369372

SCHEMBL9369372

CCC(OC)(c1cncc(OCC#Cc2ccccc2)c1)c1nccs1

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 18/20 0.79
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA7 P43166 1/20 0.35
▸ CA9 Q16790 1/20 0.35

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
SCHEMBL9434038 0.89 ALOX5 (0.62) ALOX5
SCHEMBL9369635 0.88 ALOX5 (1.00) ALOX5
SCHEMBL9433765 0.83 ALOX5 (0.87) ALOX5
SCHEMBL9433168 0.83 ALOX5 (0.82) ALOX5
SCHEMBL9374357 0.83 ALOX5 (0.63) ALOX5
SCHEMBL9369554 0.80 ALOX5 (0.84) ALOX5
SCHEMBL9369832 0.79 ALOX5 (0.82) ALOX5
SCHEMBL9375597 0.79 ALOX5 (0.82) ALOX5
SCHEMBL9369785 0.79 ALOX5 (0.82) ALOX5
SCHEMBL9375421 0.78 ALOX5 (0.80) 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-0351194-B1 Thiazole derivatives having a 5-lipoxygenase-inhibiting activity ICI PLC (GB) 1994-06-15 — — EP disclosed
US-5196422-A Antiinflammatory agents, antiallergens ICI PHARMA (FR) 1993-03-23 — — US disclosed
US-5089513-A Antiinflammatory agents; antiallergens; asthma; side effect reduction ICI PHARMA (FR) 1992-02-18 — — US disclosed
EP-0351194-A2 Thiazole derivatives having a 5-lipoxygenase-inhibiting activity IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-01-17 — — EP disclosed
Send feedback