SCHEMBL2858637

SCHEMBL2858637

CCS(=O)(=O)c1ccc(NC(C)=O)cc1CNC(=O)C(Nc1ccc2c(N)nccc2c1)(OC(=O)C(F)(F)F)c1cc(OC)ccc1OC

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F7 P08709 14/20 0.51
F3 P13726 12/20 0.51
F10 P00742 9/20 0.51
F11 P03951 9/20 0.51
F2 P00734 8/20 0.51
EPHX2 P34913 2/20 0.36
DDR1 Q08345 3/20 0.35
F9 P00740 2/20 0.35
PLAU P00749 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
KLK1 P06870 1/20 0.34

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
SCHEMBL2854982 0.94 F7 (0.48) F7F3F10F11F2
SCHEMBL2852770 0.93 F7 (0.47) F7F3F10F11F2
SCHEMBL2852631 0.90 F7 (0.52) F7F3F10F11F2
SCHEMBL2850919 0.90 F7 (0.52) F7F3F10F11F2
SCHEMBL2851039 0.89 F7 (0.48) F7F3F10F11F2
SCHEMBL2854595 0.89 F7 (0.51) F7F3F10F11F2
SCHEMBL5003720 0.88 F7 (0.47) F7F3F10F11F2
SCHEMBL2849051 0.87 F7 (0.49) F7F3F10F11F2
SCHEMBL5003040 0.86 F7 (0.49) F7F3F10F11F2
SCHEMBL2852655 0.86 F7 (0.48) F7F3F10F11F2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910298-B1 PHENYLGLYCINAMIDE AND PYRIDYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS BRISTOL MYERS SQUIBB CO (US) 2010-01-13 EP disclosed
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 10/4885F10 19/4885

“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.