SCHEMBL14404591

SCHEMBL14404591

CCN(CC)C(=N)c1ccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(CI)cn2)cc1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.76
KCNH2 Q12809 2/20 0.48

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
SCHEMBL10181912 0.87 F10 (0.80) F10KCNH2
SCHEMBL16362000 0.86 F10 (0.79) F10KCNH2
SCHEMBL12132560 0.86 F10 (1.00) F10KCNH2
SCHEMBL14404592 0.85 F10 (0.55) F10
SCHEMBL14404267 0.85 F10 (0.72) F10
SCHEMBL14404619 0.83 F10 (0.68) F10KCNH2
SCHEMBL14404266 0.83 F10 (0.61) F10
SCHEMBL14404615 0.80 F10 (0.75) F10KCNH2
SCHEMBL14629731 0.79 F10 (0.75) F10KCNH2
SCHEMBL14404477 0.78 F10 (0.79) F10

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-7285565-B2 Benzamides and related inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-10-23 US disclosed