SCHEMBL9252536

SCHEMBL9252536

NC(=O)N(O)C/C=C\Cc1ccc(Cc2ccc(F)cc2)o1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 12/20 0.42
EPHX2 P34913 1/20 0.35
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL9255678 1.00 ALOX5 (0.42) ALOX5EPHX2ALDH1A1GAASMN1; SMN2
SCHEMBL9260680 0.80 ALOX5 (0.56) ALOX5EPHX2ALDH1A1SMN1; SMN2
SCHEMBL9260118 0.80 ALOX5 (0.56) ALOX5EPHX2ALDH1A1SMN1; SMN2
SCHEMBL9285681 0.75 ALOX5 (0.46) ALOX5EPHX2ALDH1A1GAASMN1; SMN2
SCHEMBL9285478 0.75 ALOX5 (0.46) ALOX5EPHX2ALDH1A1GAASMN1; SMN2
SCHEMBL9025062 0.75 ALOX5 (0.56) ALOX5EPHX2ALDH1A1GAA
SCHEMBL9262607 0.74 ALOX5 (0.44) ALOX5EPHX2ALDH1A1SMN1; SMN2
SCHEMBL9091224 0.72 ALOX5 (0.55) ALOX5EPHX2ALDH1A1SMN1; SMN2
SCHEMBL9091217 0.72 ALOX5 (0.55) ALOX5EPHX2ALDH1A1SMN1; SMN2
SCHEMBL9257237 0.70 ALOX5 (0.42) ALOX5EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995030671-A1 SUBSTITUTED ARYL- AND HETEROARYLALKENYL-N-HYDROXYUREA INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS ABBOTT LABORATORIES (US) 1995-11-16 WO claimed
WO-1995030671-A1 SUBSTITUTED ARYL- AND HETEROARYLALKENYL-N-HYDROXYUREA INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS ABBOTT LABORATORIES (US) 1995-11-16 WO disclosed