SCHEMBL19129013

SCHEMBL19129013

CC(=N)N(C)c1ccc(C(=O)Nc2ccc(F)cc2C(=O)Nc2ccc(Cl)cn2)cc1

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.81
KCNH2 Q12809 4/20 0.66
KLKB1 P03952 3/20 0.65
F2 P00734 1/20 0.60

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
SCHEMBL2431818 0.92 F10 (0.87) F10KCNH2KLKB1
SCHEMBL2431134 0.90 F10 (1.00) F10KCNH2KLKB1F2
SCHEMBL19128999 0.89 F10 (0.72) F10KCNH2KLKB1
SCHEMBL10146279 0.88 F10 (1.00) F10KCNH2F2
SCHEMBL2438967 0.87 F10 (0.79) F10KCNH2KLKB1F2
SCHEMBL6107538 0.87 F10 (0.70) F10KCNH2KLKB1
SCHEMBL2439114 0.87 F10 (0.78) F10KCNH2
SCHEMBL5392608 0.86 F10 (0.79) F10KCNH2KLKB1
SCHEMBL6109322 0.85 F10 (0.67) F10KCNH2KLKB1
SCHEMBL10146317 0.85 F10 (0.77) F10KCNH2KLKB1F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9708265-B2 Urethanes, ureas, amidines and related inhibitors of factor Xa PHARMADIALL LIMITED LIABILITY COMPANY (RU) 2017-07-18 US disclosed
US-9708265-B2 Urethanes, ureas, amidines and related inhibitors of factor Xa PHARMADIALL LIMITED LIABILITY COMPANY (RU) 2017-07-18 US disclosed