SCHEMBL8942640

SCHEMBL8942640

C[C@H](CN(O)C(=O)c1ccc(Oc2ccc(SF)cc2)o1)NC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 12/20 0.41
ACACB O00763 2/20 0.37
ACACA Q13085 2/20 0.36
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
KLKB1 P03952 1/20 0.31

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
SCHEMBL8942314 1.00 ALOX5 (0.41) ALOX5ACACBACACAALDH1A1MAPT
SCHEMBL8942397 0.89 ALOX5 (0.52) ALOX5ACACBACACA
SCHEMBL8942835 0.89 ALOX5 (0.52) ALOX5ACACBACACA
SCHEMBL8942621 0.89 ALOX5 (0.52) ALOX5ACACBACACA
SCHEMBL8942749 0.79 ALOX5 (0.48) ALOX5ACACBACACA
SCHEMBL8783185 0.74 ALOX5 (0.59) ALOX5ALDH1A1MAPT
SCHEMBL8783178 0.74 ALOX5 (0.59) ALOX5ALDH1A1MAPT
SCHEMBL8782867 0.74 ALOX5 (0.45) ALOX5ALDH1A1MAPTKLKB1
SCHEMBL8782995 0.74 ALOX5 (0.45) ALOX5ALDH1A1MAPTKLKB1
SCHEMBL8782860 0.74 ALOX5 (0.45) ALOX5ALDH1A1MAPTKLKB1

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