SCHEMBL763989

SCHEMBL763989

CN1CCc2nc(C(=O)/C=C/C[C@H]3CCCC[C@@H]3NC(=O)c3cc4ccc(Cl)cc4s3)sc2C1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.55
F2 P00734 4/20 0.53

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
SCHEMBL12631592 0.86 F10 (0.69) F10F2
SCHEMBL12036015 0.86 F10 (0.69) F10F2
Hydrochloric Acid SCHEMBL2934115 0.86 F10 (0.68) F10F2
Hydrochloric Acid SCHEMBL4083614 0.86 F10 (0.68) F10F2
Hydrochloric Acid SCHEMBL2934113 0.86 F10 (0.68) F10F2
SCHEMBL11888207 0.85 F10 (0.55) F10F2
SCHEMBL11888221 0.84 F10 (0.77) F10F2
SCHEMBL11888211 0.83 F10 (0.76) F10F2
SCHEMBL11888226 0.76 F10 (0.74) F10F2
SCHEMBL10279610 0.73 F10 (0.77) F10F2

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
EP-2431370-A1 Monoacylated 1,2-diaminocycloalkanes DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2012-03-21 EP disclosed
EP-2343290-A1 Diamine derivatives as factor X inhibitors Daiichi Sankyo Company, Limited (JP) 2011-07-13 EP disclosed