SCHEMBL9260680

SCHEMBL9260680

NC(=O)N(O)C/C=C/Cc1ccc(Cc2ccc(F)cc2)s1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 13/20 0.56
EPHX2 P34913 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
NFKB1 P19838 1/20 0.32
RAB9A P51151 1/20 0.32
NFKB2 Q00653 1/20 0.32
KMT2A Q03164 1/20 0.32
RELA Q04206 1/20 0.32
ABL1 P00519 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
SCHEMBL9260118 1.00 ALOX5 (0.56) ALOX5EPHX2SMN1; SMN2KDM4EMEN1
SCHEMBL9262607 0.89 ALOX5 (0.44) ALOX5EPHX2SMN1; SMN2NPC1ALDH1A1
SCHEMBL9257237 0.88 ALOX5 (0.42) ALOX5EPHX2MEN1LMNAKMT2A
SCHEMBL9258162 0.85 ALOX5 (0.46) ALOX5EPHX2LMNA
SCHEMBL9260002 0.85 ALOX5 (0.40) ALOX5EPHX2
SCHEMBL9091224 0.84 ALOX5 (0.55) ALOX5EPHX2SMN1; SMN2KDM4EMEN1
SCHEMBL9091217 0.84 ALOX5 (0.55) ALOX5EPHX2SMN1; SMN2KDM4EMEN1
SCHEMBL9285681 0.82 ALOX5 (0.46) ALOX5EPHX2SMN1; SMN2KDM4EMEN1
SCHEMBL9285478 0.82 ALOX5 (0.46) ALOX5EPHX2SMN1; SMN2KDM4EMEN1
SCHEMBL13696940 0.81 ALOX5 (0.63) 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