SCHEMBL7404175

SCHEMBL7404175

N/N=C(/N)N(C(N)=O)C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.38
ALOX5 P09917 3/20 0.37
FDPS P14324 1/20 0.31
ADH1A P07327 1/20 0.30
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30
PAX8 Q06710 1/20 0.30

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
SCHEMBL7404178 1.00 EPHX1 (0.38) EPHX1ALOX5FDPSADH1ACES2
SCHEMBL6827765 0.83 ALOX5 (0.45) EPHX1ALOX5FDPSADH1ACES2
SCHEMBL22729195 0.80 ALOX5 (0.43) EPHX1ALOX5FDPSADH1ACES2
SCHEMBL3083216 0.78 CES2 (0.41) EPHX1ALOX5CES2CES1
SCHEMBL1957147 0.77 ALOX5 (0.41) EPHX1ALOX5FDPSADH1ACES2
SCHEMBL3069635 0.75 ALOX5 (0.39) EPHX1ALOX5FDPSADH1ACES2
SCHEMBL28496043 0.75 ALOX5 (0.39) EPHX1ALOX5FDPSADH1ACES2
SCHEMBL6235316 0.73 ALOX5 (0.38) EPHX1ALOX5FDPSADH1ACES2
SCHEMBL6242109 0.71 ALOX5 (0.36) EPHX1ALOX5ADH1A
SCHEMBL7611692 0.71 ALOX5 (0.37) 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
EP-0505322-A1 Aminoguanidines SANDOZ LTD. (CH) 1992-09-23 EP disclosed