SCHEMBL7128698

SCHEMBL7128698

C=C(F)CC1=CNc2ccccc2O1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.38
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL7818468 0.80 ALOX5 (0.40) ALOX5GAA
SCHEMBL3636655 0.79 ALOX5 (0.43) ALOX5GAANPSR1
SCHEMBL9933935 0.79 ALOX5 (0.43) ALOX5GAANPSR1
SCHEMBL9933931 0.77 ALOX5 (0.45) ALOX5GAANPSR1
SCHEMBL3638132 0.76 ALOX5 (0.45) ALOX5GAANPSR1
SCHEMBL3805431 0.76 ALOX5 (0.41) ALOX5GAANPSR1
SCHEMBL3638693 0.73 ALOX5 (0.42) ALOX5GAANPSR1
SCHEMBL3637187 0.69 ALOX5 (0.48) ALOX5GAANPSR1
SCHEMBL9934059 0.65 ALOX5 (0.48) ALOX5GAANPSR1
SCHEMBL22053502 0.65 ALOX5 (0.43) ALOX5GAANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6762193-B1 Method of treating hair loss SANDERS JR RICHARD J (US) 2004-07-13 US disclosed
US-6440994-B1 Method of treating acne SANDERS JR RICHARD J (US) 2002-08-27 US disclosed
US-5486515-A 2-fluoroalkyl-1,4-benzoxaxines as potassium channel mediators ZENECA LIMITED (GB) 1996-01-23 US disclosed