SCHEMBL21088933

SCHEMBL21088933

Nc1ncc(-c2ccc(-c3ccccc3[S+]([O-])NCCO)cn2)cn1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 20/20 0.46
ALOX5AP P20292 19/20 0.46

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
SCHEMBL20627315 0.84 FEN1 (0.60) FEN1ALOX5AP
SCHEMBL20626957 0.84 FEN1 (0.45) FEN1ALOX5AP
SCHEMBL20627164 0.83 ALOX5AP (0.58) FEN1ALOX5AP
SCHEMBL21089222 0.81 FEN1 (0.59) FEN1ALOX5AP
SCHEMBL20627239 0.81 FEN1 (0.58) FEN1ALOX5AP
SCHEMBL21089205 0.80 ALOX5AP (0.56) FEN1ALOX5AP
SCHEMBL20627312 0.78 FEN1 (0.57) FEN1ALOX5AP
SCHEMBL20626910 0.76 FEN1 (0.63) FEN1ALOX5AP
SCHEMBL20627167 0.75 FEN1 (0.59) FEN1ALOX5AP
SCHEMBL20626962 0.74 ALOX5AP (0.49) FEN1ALOX5AP

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-3495359-A1 FLAP MODULATORS Janssen Pharmaceutica NV (BE) 2019-06-12 EP disclosed