SCHEMBL9440548

SCHEMBL9440548

COC1(c2cc(F)cc(Sc3ccc(Oc4ccc(CCCN(C)C)cc4)cc3)c2)CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 18/20 0.43
KCNH2 Q12809 1/20 0.36

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
SCHEMBL9440517 0.86 ALOX5 (0.44) ALOX5
SCHEMBL9440485 0.82 ALOX5 (0.44) ALOX5
SCHEMBL9440580 0.81 ALOX5 (0.41) ALOX5
SCHEMBL9440421 0.81 ALOX5 (0.43) ALOX5
SCHEMBL9258010 0.80 ALOX5 (0.46) ALOX5
SCHEMBL9038104 0.79 ALOX5 (0.51) ALOX5
SCHEMBL9440584 0.79 ALOX5 (0.48) ALOX5
SCHEMBL9036795 0.79 ALOX5 (0.48) ALOX5
SCHEMBL9221207 0.78 ALOX5 (0.49) ALOX5
SCHEMBL9047329 0.77 ALOX5 (0.46) 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
US-5276037-A Antiinflammatory agents, antiallergens IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-01-04 US disclosed
US-5272173-A 5-lipoxygenase inhibitors IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-12-21 US disclosed
US-5225438-A Lipoxygenase inhibitors for antiinflammatory agents or antiallergens IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-07-06 US disclosed
EP-0488602-A1 Aryl derivatives ZENECA LIMITED (GB) 1992-06-03 EP disclosed