SCHEMBL3901372

SCHEMBL3901372

N=C(N)c1cccc(OCCN(C(=O)C(F)(F)F)c2ccc(C(=O)N3CCCC3)cc2)c1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.64
PRSS1 P07477 12/20 0.56

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
SCHEMBL5105097 0.99 F10 (0.62) F10PRSS1
SCHEMBL3896207 0.88 F10 (0.48) F10PRSS1
SCHEMBL3899012 0.87 F10 (0.47) F10PRSS1
SCHEMBL3903062 0.86 F10 (0.52) F10PRSS1
SCHEMBL3907503 0.85 F10 (0.50) F10PRSS1
SCHEMBL3911485 0.85 F10 (0.53) F10PRSS1
SCHEMBL3896379 0.84 PRSS1 (0.50) F10PRSS1
SCHEMBL3911553 0.84 F10 (0.51) F10PRSS1
SCHEMBL3912117 0.84 PRSS1 (0.50) F10PRSS1
SCHEMBL3911248 0.83 F10 (0.50) F10PRSS1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0976722-B1 BENZAMIDINE DERIVATIVES AJINOMOTO KK (JP) 2009-03-11 EP disclosed
US-7396844-B1 Benzamidine derivatives AJINOMOTO CO., INC. (JP) 2008-07-08 US disclosed
EP-0976722-A1 BENZAMIDINE DERIVATIVES Ajinomoto Co., Inc. (JP) 2000-02-02 EP disclosed