SCHEMBL8166226

SCHEMBL8166226

CN(C)C(=N)c1ccc(NC(=O)c2nnnn2-c2ccc3cc(Cl)ccc3c2)c(F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 1.00
F2 P00734 1/20 0.54
KCNH2 Q12809 1/20 0.47

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
SCHEMBL8165956 0.91 F10 (0.84) F10F2
SCHEMBL8165600 0.91 F10 (0.84) F10F2
SCHEMBL8166313 0.90 F10 (0.81) F10F2
SCHEMBL8166972 0.86 F10 (0.76) F10
SCHEMBL8170278 0.84 F10 (1.00) F10F2
SCHEMBL8165672 0.84 F10 (1.00) F10F2
SCHEMBL8169809 0.82 F10 (1.00) F10F2
SCHEMBL8170664 0.82 F10 (1.00) F10
SCHEMBL8158680 0.80 F10 (1.00) F10F2
SCHEMBL8165468 0.79 F10 (0.65) 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
US-20040116399-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2004-06-17 US disclosed
US-20040116399-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2004-06-17 US disclosed