SCHEMBL2913796

SCHEMBL2913796

CC(C)(C)OC(=O)N(OC(C)(C)C)c1nccc2cc(NC(C(=O)O)c3cc(Cl)ccc3F)ccc12

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F7 P08709 10/20 0.34
F3 P13726 10/20 0.34
F2 P00734 4/20 0.34
F10 P00742 4/20 0.34
F11 P03951 4/20 0.34
S1PR3 Q99500 1/20 0.34
GRM4 Q14833 1/20 0.31
AAK1 Q2M2I8 2/20 0.31
P2RX3 P56373 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NR1H4 Q96RI1 2/20 0.31
ACVR1B P36896 1/20 0.30
TGFBR1 P36897 1/20 0.30
ACVRL1 P37023 1/20 0.30

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
SCHEMBL2848619 0.92 F7 (0.41) F7F3F2F10F11
SCHEMBL2913794 0.91 F7 (0.35) F7F3F2F10F11
SCHEMBL2916694 0.90 F7 (0.34) F7F3F2F10F11
SCHEMBL2908967 0.90 F7 (0.37) F7F3F2F10F11
SCHEMBL2852068 0.90 NR1H4 (0.35) F7F3F2F10F11
SCHEMBL2850814 0.90 F7 (0.42) F7F3F2F10F11
SCHEMBL2916735 0.88 F7 (0.35) F7F3F2F10F11
SCHEMBL4999821 0.88 F7 (0.39) F7F3F2F10F11
SCHEMBL4332034 0.87 F7 (0.37) F7F3F2F10F11
SCHEMBL2908391 0.86 F7 (0.34) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1856096-B1 PHENYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS BRISTOL MYERS SQUIBB CO (US) 2010-09-01 EP disclosed
US-7622585-B2 Phenylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2009-11-24 US disclosed
EP-1856096-A2 PHENYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS Bristol-Myers Squibb Company (US) 2007-11-21 EP disclosed
US-20060166997-A1 Phenylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY 2006-07-27 US disclosed
WO-2006076246-A2 PHENYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY (US) 2006-07-20 WO 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-20060166997-A1 Phenylglycinamide derivatives useful as anticoagulants TFPI, SERPINC1, SERPINE1 F7 35/4885F3 20/4885F2 9/4885

“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.