SCHEMBL8942702

SCHEMBL8942702

Cc1ccc(Oc2ccc(C(=O)N(O)CCNC(N)=O)o2)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.38
KLKB1 P03952 1/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
ALOX5 P09917 6/20 0.37
MMP13 P45452 1/20 0.37
MAPK14 Q16539 1/20 0.37
KMT2A Q03164 3/20 0.35
PARP10 Q53GL7 1/20 0.35
MEN1 O00255 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL8942383 0.88 ALDH1A1 (0.45) EPHX2ALDH1A1MAPTALOX5HPGD
SCHEMBL8942311 0.88 ALOX5 (0.49) EPHX2ALDH1A1MAPTALOX5
SCHEMBL8942307 0.88 KLKB1 (0.43) EPHX2KLKB1ALDH1A1MAPTALOX5
SCHEMBL8782600 0.85 KLKB1 (0.44) EPHX2KLKB1ALDH1A1MAPTALOX5
SCHEMBL9366489 0.74 ALOX5 (0.43) KLKB1ALDH1A1MAPTALOX5PARP10
SCHEMBL8942749 0.74 ALOX5 (0.48) ALOX5KMT2AMEN1
SCHEMBL8782994 0.74 KLKB1 (0.48) KLKB1ALDH1A1MAPTALOX5HPGD
SCHEMBL8783029 0.74 ALDH1A1 (0.50) EPHX2KLKB1ALDH1A1MAPTALOX5
SCHEMBL8783508 0.74 ALOX5 (0.54) ALDH1A1MAPTALOX5
SCHEMBL8942397 0.71 ALOX5 (0.52) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5514702-A Arylamidoalkyl-N-hydroxyurea compounds having lipoxygenase inhibitory activity ABBOTT LABORATORIES (US) 1996-05-07 US disclosed