SCHEMBL5006932

SCHEMBL5006932

CCc1ccc(F)c(C(Nc2ccc3c(N)nccc3c2)(OC(=O)C(F)(F)F)C(=O)NCc2cccc(NC(C)=O)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F7 P08709 12/20 0.52
F3 P13726 12/20 0.52
F2 P00734 9/20 0.48
F10 P00742 9/20 0.48
F11 P03951 9/20 0.48
ROCK1 Q13464 2/20 0.38
RIPK1 Q13546 1/20 0.37
KLKB1 P03952 3/20 0.36
F9 P00740 1/20 0.36
KLK1 P06870 1/20 0.36
DOT1L Q8TEK3 1/20 0.35
PRMT7 Q9NVM4 1/20 0.35

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
SCHEMBL4999669 0.93 F7 (0.51) F7F3F2F10F11
SCHEMBL5004056 0.92 F7 (0.49) F7F3F2F10F11
SCHEMBL5009095 0.91 F7 (0.49) F7F3F2F10F11
SCHEMBL5008822 0.91 F7 (0.48) F7F3F2F10F11
SCHEMBL2854560 0.88 F7 (0.49) F7F3F2F10F11
SCHEMBL5003888 0.87 F7 (0.52) F7F3F2F10F11
SCHEMBL5003872 0.86 F7 (0.49) F7F3F2F10F11
SCHEMBL5006513 0.85 F7 (0.49) F7F3F2F10F11
SCHEMBL5003040 0.85 F7 (0.49) F7F3F2F10F11
SCHEMBL5004006 0.84 F7 (0.51) 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.