SCHEMBL8353097

SCHEMBL8353097

COc1ccc(-n2nc(C(N)=O)c3c2C(=O)N(c2ccc(-c4ccccc4CNCCO)cc2)CC3)cc1

nearest known ligand 0.84

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.84
F2 P00734 7/20 0.71
SLC29A1 Q99808 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
SCHEMBL5438232 0.91 F10 (1.00) F10F2SLC29A1
SCHEMBL6781669 0.89 F10 (1.00) F10F2SLC29A1
SCHEMBL6783316 0.87 F10 (0.72) F10F2
SCHEMBL6785643 0.86 F10 (1.00) F10F2
SCHEMBL8354493 0.85 F10 (0.87) F10F2
SCHEMBL6792898 0.85 F10 (1.00) F10F2
SCHEMBL6494095 0.84 F10 (0.83) F10F2
SCHEMBL6782538 0.83 F10 (1.00) F10F2
SCHEMBL6493883 0.83 F10 (0.84) F10F2
SCHEMBL3886027 0.82 F10 (0.78) F10F2SLC29A1

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
WO-2003047520-A2 SUBSTITUTED AMINO METHYL FACTOR Xa INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-06-12 WO disclosed