SCHEMBL1325070

SCHEMBL1325070

N=C(N)c1ccc2[nH]c(-c3cccc(-c4ccccc4)c3O)cc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F2 P00734 14/20 1.00
PLAU P00749 14/20 1.00
PRSS1 P07477 14/20 1.00
PLAT P00750 13/20 1.00
F10 P00742 12/20 1.00
PLG P00747 10/20 1.00
PRSS2 P07478 7/20 1.00
PRSS3 P35030 7/20 1.00
F7 P08709 6/20 1.00
KLKB1 P03952 5/20 1.00
HPN P05981 4/20 0.70
ST14 Q9Y5Y6 2/20 0.70
F3 P13726 2/20 0.69

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
SCHEMBL29682938 1.00 F2 (1.00) F2PLAUPRSS1PLATF10
SCHEMBL6292958 0.87 F2 (1.00) F2PLAUPRSS1PLATF10
SCHEMBL1325228 0.85 PLAU (0.74) F2PLAUPRSS1PLATF10
SCHEMBL23752572 0.84 F2 (0.78) F2PLAUPRSS1PLATF10
SCHEMBL13208176 0.84 F2 (1.00) F2PLAUPRSS1PLATF10
SCHEMBL4995709 0.83 F2 (1.00) F2PLAUPRSS1PLATF10
SCHEMBL18817939 0.82 HPN (1.00) F2PLAUPRSS1PLATF10
SCHEMBL6690412 0.82 F7 (1.00) F2PLAUPRSS1PLATF10
SCHEMBL7484247 0.82 F2 (0.71) F2PLAUPRSS1PLATF10
SCHEMBL4321170 0.81 PLAU (1.00) F2PLAUPRSS1PLATF10

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6867200-B1 (Hetero)aryl-bicyclic heteroaryl derivatives, their preparation and their use as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-03-15 US claimed
EP-1140859-A2 (HETERO)ARYL-BICYCLIC HETEROARYL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2001-10-10 EP claimed
WO-2000035886-A2 (HETERO)ARYL-BICYCLIC HETEROARYL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2000-06-22 WO claimed
EP-2982668-A2 2-(2-HYDROXYBIPHENYL-3-YL)-1H-BENZOIMIDAZOLE-5-CARBOXAMIDINE DERIVATIVES AS FACTOR VIIA INHIBITORS FOR THE TREATMENT OF THROMBOEMBOLIC DISORDERS Pharmacyclics LLC (US) 2016-02-10 EP disclosed
US-9181280-B2 Factor VIIa inhibitor PHARMACYCLICS LLC (US) 2015-11-10 US disclosed
US-9162986-B2 2-(2-hydroxybiphenyl-3-yl)-1H-benzoimidazole-5-carboxamidine derivatives as factor VIIA inhibitors PHARMACYCLICS LLC (US) 2015-10-20 US disclosed
EP-1569912-B1 2-(2-HYDROXYBIPHENYL-3-YL)-1H-BENZOIMIDAZOLE-5-CARBOXAMIDINE DERIVATIVES AS FACTOR VIIA INHIBITORS PHARMACYCLICS INC (US) 2015-04-29 EP disclosed
US-20140378453-A1 2-(2-HYDROXYBIPHENYL-3-YL)-1H-BENZOIMIDAZOLE-5-CARBOXAMIDINE DERIVATIVES AS FACTOR VIIA INHIBITORS PHARMACYCLICS LLC 2014-12-25 US disclosed
US-20140221667-A1 FACTOR VIIA INHIBITOR PHARMACYCLICS, INC. (US) 2014-08-07 US disclosed
US-8778625-B2 2-(2-hydroxybiphenyl-3-yl)-1H-Benzoimidazole-5-carboxamidine derivatives as factor VIIA inhibitors PHARMACYCLICS, INC. (US) 2014-07-15 US disclosed
US-8729117-B2 Factor VIIa inhibitor PHARMACYCLICS, INC. (US) 2014-05-20 US disclosed
US-20080275250-A1 Factor Viia Inhibitor PHARMACYCLICS, INC. (US) 2008-11-06 US disclosed
EP-1761504-A2 FACTOR VIIA INHIBITOR PHARMACYCLICS, INC. (US) 2007-03-14 EP disclosed
US-20060205942-A1 e.g. 2-{2-[545-carbamimidoyl-1H-benzoimidazol-2-yl)-6,2'-dihydroxy-5'-sulthmoyl-biphenyl-3-yl]-acetylsmino}-succinamic; anticoagulant, anticarcinogenic, antiinflammatory agent; deep vein thrombosis, rheumatoid arthritis, stroke PHARMACYCLICS LLC 2006-09-14 US disclosed
WO-2005118554-A2 FACTOR VIIA INHIBITOR PHARMACYCLICS, INC. (US) 2005-12-15 WO disclosed
EP-1569912-A2 2-(2-HYDROXYBIPHENYL-3-YL)-1H-BENZOIMIDAZOLE-5-CARBOXAMIDINE DERIVATIVES AS FACTOR VIIA INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2005-09-07 EP disclosed
US-6867200-B1 (Hetero)aryl-bicyclic heteroaryl derivatives, their preparation and their use as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-03-15 US disclosed
WO-2004050637-A2 2-(2-HYDROXYBIPHENYL-3-YL)-1H-BENZOIMIDAZOLE-5-CARBOXAMIDINE DERIVATIVES AS FACTOR VIIA INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2004-06-17 WO disclosed
EP-1140859-A2 (HETERO)ARYL-BICYCLIC HETEROARYL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2001-10-10 EP disclosed
WO-2000035886-A2 (HETERO)ARYL-BICYCLIC HETEROARYL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2000-06-22 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 (4 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-20060205942-A1 e.g. 2-{2-[545-carbamimidoyl-1H-benzoimidazol-2-yl)-6,2'-dihydroxy-5'-sulthmoyl-biphenyl-3-yl]-acetylsmino}-succinamic; anticoagulant, anticarcinogenic, antiinflammatory agent; deep vein thrombosis, rheumatoid arthritis, stroke F7, F9, F5 F2 10/4885PLAU 210/4885PRSS1 138/4885
US-20140221667-A1 FACTOR VIIA INHIBITOR F7, F9, F5 F2 16/4885PLAU 37/4885PRSS1 231/4885
US-20140378453-A1 2-(2-HYDROXYBIPHENYL-3-YL)-1H-BENZOIMIDAZOLE-5-CARBOXAMIDINE DERIVATIVES AS FACTOR VIIA INHIBITORS F13B, HABP2, F7 F2 17/4885PLAU 37/4885PRSS1 391/4885
US-20080275250-A1 Factor Viia Inhibitor F7, F9, F5 F2 16/4885PLAU 37/4885PRSS1 231/4885

“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.