SCHEMBL4333411

SCHEMBL4333411

CCOc1cc(C(Nc2ccc(C#N)cc2)C(=O)OC)ccc1OC(C)C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F7 P08709 19/20 0.49
F3 P13726 18/20 0.49
F2 P00734 7/20 0.45
F10 P00742 7/20 0.45
F11 P03951 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
PRSS1 P07477 2/20 0.44
PRSS2 P07478 2/20 0.44
PRSS3 P35030 2/20 0.44

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
SCHEMBL7443963 0.94 F7 (0.49) F7F3F2F10F11
SCHEMBL3856774 0.91 F7 (0.52) F7F3F2F10F11
SCHEMBL5133553 0.85 F7 (0.44) F7F3F2F10F11
SCHEMBL3853926 0.85 F7 (0.56) F7F3F2F10F11
SCHEMBL3853924 0.84 F7 (0.53) F7F3F2F10F11
SCHEMBL3853921 0.84 F7 (0.53) F7F3F2F10F11
SCHEMBL5037211 0.83 F7 (0.66) F7F3F2F10F11
SCHEMBL3463923 0.83 F7 (0.69) F7F3F2F10F11
SCHEMBL5882260 0.83 F7 (0.58) F7F3F2F10F11
SCHEMBL2538383 0.82 LMNA (0.40) F7F3F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-7250447-B2 Acylsulfamide inhibitors of factor VIIa GENENTECH, INC. (US) 2007-07-31 US disclosed
US-20070037813-A1 Serine Protease Inhibitors GENENTECH, INC. (US) 2007-02-15 US disclosed
US-20070037814-A1 ACYLSULFAMIDE INHIBITORS OF FACTOR VIIa GENENTECH, INC. (US) 2007-02-15 US 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
EP-1628954-A2 ACYLSULFAMIDE INHIBITORS OF FACTOR VIIA Genentech, Inc. (US) 2006-03-01 EP disclosed
EP-1144373-B1 SERINE PROTEASE INHIBITORS GENENTECH INC (US) 2005-10-19 EP disclosed
US-20050186198-A1 Serine protease inhibitors GENENTECH, INC. 2005-08-25 US disclosed
US-6919369-B2 Controlling blood coagulation GENENTECH, INC. (US) 2005-07-19 US disclosed
WO-2004113278-A2 ACYLSULFAMIDE INHIBITORS OF FACTOR VIIA GENENTECH, INC. (US) 2004-12-29 WO disclosed
US-20040242585-A1 Acylsulfamide inhibitors of factor VIIa GENENTECH, INC. 2004-12-02 US disclosed
US-20030212071-A1 Serine protease inhibitors GENENTECH, INC. 2003-11-13 US disclosed
US-6472393-B1 Serine protease inhibitors GENENTECH, INC. 2002-10-29 US disclosed
EP-1144373-A3 SERINE PROTEASE INHIBITORS Genentech, Inc. (US) 2002-01-02 EP disclosed
EP-1144373-A2 SERINE PROTEASE INHIBITORS Genentech, Inc. (US) 2001-10-17 EP disclosed
WO-2000041531-A2 SERINE PROTEASE INHIBITORS GENENTECH, INC. (US) 2000-07-20 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 (6 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-20030212071-A1 Serine protease inhibitors SERPINE1, SPINT2, TFPI F7 22/4885F3 45/4885F2 12/4885
US-20070037813-A1 Serine Protease Inhibitors TFPI, SPINT2, SERPINE1 F7 17/4885F3 43/4885F2 10/4885
US-20050186198-A1 Serine protease inhibitors TFPI, SPINT2, SERPINE1 F7 17/4885F3 43/4885F2 10/4885
US-20070037814-A1 ACYLSULFAMIDE INHIBITORS OF FACTOR VIIa TFPI, HABP2, TFPI2 F7 4/4885F3 41/4885F2 28/4885
US-20060166997-A1 Phenylglycinamide derivatives useful as anticoagulants TFPI, SERPINC1, SERPINE1 F7 35/4885F3 20/4885F2 9/4885
US-20040242585-A1 Acylsulfamide inhibitors of factor VIIa TFPI, TFPI2, HABP2 F7 6/4885F3 46/4885F2 32/4885

“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.