SCHEMBL5008923

SCHEMBL5008923

CCOc1cc(C(Nc2ccc3c(N)nccc3c2)(OC(=O)C(F)(F)F)C(=O)NCc2cccc(NS(C)(=O)=O)c2)ccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F7 P08709 15/20 0.46
F3 P13726 15/20 0.46
F2 P00734 11/20 0.46
F10 P00742 10/20 0.46
F11 P03951 10/20 0.46
KLKB1 P03952 2/20 0.39
ROCK1 Q13464 1/20 0.37
DHFR P00374 1/20 0.36

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
SCHEMBL5003148 0.91 F7 (0.58) F7F3F2F10F11
SCHEMBL5009131 0.86 F7 (0.65) F7F3F2F10F11
SCHEMBL5006635 0.85 F7 (0.49) F7F3F2F10F11
SCHEMBL5003691 0.84 F7 (0.49) F7F3F2F10F11
SCHEMBL5003888 0.84 F7 (0.52) F7F3F2F10F11
SCHEMBL5006513 0.83 F7 (0.49) F7F3F2F10F11
SCHEMBL4999738 0.83 F7 (0.57) F7F3F2F10F11
SCHEMBL4999339 0.83 F7 (0.55) F7F3F2F10F11
SCHEMBL4612467 0.82 F7 (0.55) F7F3F2F10F11
SCHEMBL4999809 0.82 F7 (0.53) F7F3F2F10F11

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-7456195-B2 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-25 US disclosed
US-20070003539-A1 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070003539-A1 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants F12, F11, F7 F7 3/4885F3 10/4885F2 4/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.