SCHEMBL799533

SCHEMBL799533

CN(C)C(=N)c1ccc(C(=O)Nc2ccc(CO)cc2C(=O)Nc2ccc(Cl)cn2)cc1

nearest known ligand 0.86

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 18/20 0.86
KCNH2 Q12809 4/20 0.82
F2 P00734 1/20 0.74

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
SCHEMBL10177790 0.90 F10 (1.00) F10KCNH2F2
SCHEMBL10063542 0.88 F10 (0.88) F10KCNH2F2
SCHEMBL12045550 0.88 F10 (0.68) F10KCNH2
SCHEMBL799840 0.87 F10 (1.00) F10KCNH2F2
SCHEMBL10181142 0.87 F10 (0.85) F10KCNH2F2
SCHEMBL10146279 0.87 F10 (1.00) F10KCNH2F2
SCHEMBL12132919 0.87 F10 (0.85) F10KCNH2F2
Betrixaban SCHEMBL158591 0.85 F10 (1.00) F10KCNH2F2
Betrixaban SCHEMBL29374026 0.85 F10 (1.00) F10KCNH2F2
SCHEMBL12134308 0.85 F10 (0.82) F10KCNH2F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180028510-A1 PREVENTION AND TREATMENT OF THROMBOSIS IN MEDICALLY ILL PATIENTS ALEXION PHARMACEUTICALS, INC. 2018-02-01 US disclosed
US-20170326119-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR MILLENNIUM PHARMACEUTICALS, INC. 2017-11-16 US disclosed
US-9555023-B2 Pharmaceutical salts and polymorphs of a factor Xa inhibitor MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-01-31 US disclosed
US-20160101089-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR MILLENNIUM PHARMACEUTICALS, INC. 2016-04-14 US disclosed
US-9221758-B2 Methods of synthesizing pharmaceutical salts of a factor Xa inhibitor MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-12-29 US disclosed
US-20150224091-A1 PREVENTION AND TREATMENT OF THROMBOSIS IN MEDICALLY ILL PATIENTS PORTOLA PHARMACEUTICALS, INC. 2015-08-13 US disclosed
US-9061019-B2 Pharmaceutical salts and polymorphs of a factor Xa inhibitor MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-06-23 US disclosed
US-8987463-B2 Methods of synthesizing factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-03-24 US disclosed
US-8946219-B2 Combination therapy with a compound acting as a platelet ADP receptor inhibitor PORTOLA PHARMACEUTICALS, INC. (US) 2015-02-03 US disclosed
US-8946269-B2 Crystalline forms of a factor Xa inhibitor PORTOLA PHARMACEUTICALS, INC. (US) 2015-02-03 US disclosed
US-20140323497-A1 METHODS AND FORMULATIONS OF TREATING THROMBOSIS WITH BETRIXABAN AND A P-GLYCOPROTEIN INHIBITOR PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-30 US disclosed
US-20140288028-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR MILLENNIUM PHARMACEUTICALS, INC. 2014-09-25 US disclosed
US-20140046071-A1 Methods of Synthesizing Pharmaceutical Salts of a Factor Xa Inhibitor MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-02-13 US disclosed
US-20130211094-A1 METHODS OF SYNTHESIZING FACTOR Xa INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-08-15 US disclosed
US-8455440-B2 Combination anticoagulant therapy with a compound that acts as a factor Xa inhibitor MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-04 US disclosed
US-20130064806-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR MILLENNIUM PHARMACEUTICALS, INC. 2013-03-14 US disclosed
US-20120095019-A1 METHODS AND FORMULATIONS OF TREATING THROMBOSIS WITH BETRIXABAN AND A P-GLYCOPROTEIN INHIBITOR ALEXION PHARMACEUTICALS, INC. 2012-04-19 US disclosed
US-20120071519-A1 CRYSTALLINE FORMS OF A FACTOR Xa INHIBITOR ALEXION PHARMACEUTICALS, INC. 2012-03-22 US disclosed
US-20120046230-A1 Combination Anticoagulant Therapy With A Compound That Acts As A Factor Xa Inhibitor MILLENNIUM PHARMACEUTICALS, INC. 2012-02-23 US disclosed
US-20110033459-A1 COMBINATION THERAPY WITH A COMPOUND ACTING AS A PLATELET ADP RECEPTOR INHIBITOR PORTOLA PHARMACEUTICALS, INC. 2011-02-10 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 (13 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-20170326119-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR F12, F11, TFPI F10 10/4885KCNH2 3549/4885F2 7/4885
US-20150224091-A1 PREVENTION AND TREATMENT OF THROMBOSIS IN MEDICALLY ILL PATIENTS SERPINC1, TBXA2R, PLAT F10 37/4885KCNH2 2677/4885F2 12/4885
US-20120071519-A1 CRYSTALLINE FORMS OF A FACTOR Xa INHIBITOR F12, F9, F11 F10 5/4885KCNH2 2595/4885F2 8/4885
US-20140046071-A1 Methods of Synthesizing Pharmaceutical Salts of a Factor Xa Inhibitor F12, F11, TFPI F10 12/4885KCNH2 2097/4885F2 11/4885
US-20130064806-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR F12, F11, TFPI F10 10/4885KCNH2 3549/4885F2 7/4885
US-20120046230-A1 Combination Anticoagulant Therapy With A Compound That Acts As A Factor Xa Inhibitor SERPINC1, F2, TFPI F10 6/4885KCNH2 1976/4885F2 2/4885
US-20140323497-A1 METHODS AND FORMULATIONS OF TREATING THROMBOSIS WITH BETRIXABAN AND A P-GLYCOPROTEIN INHIBITOR ABCB1, PLAT, TFPI F10 32/4885KCNH2 728/4885F2 31/4885
US-20140288028-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR F12, F11, TFPI F10 10/4885KCNH2 3549/4885F2 7/4885
US-20120095019-A1 METHODS AND FORMULATIONS OF TREATING THROMBOSIS WITH BETRIXABAN AND A P-GLYCOPROTEIN INHIBITOR ABCB1, PLAT, TFPI F10 32/4885KCNH2 728/4885F2 31/4885
US-20130211094-A1 METHODS OF SYNTHESIZING FACTOR Xa INHIBITORS F12, F9, F7 F10 11/4885KCNH2 1354/4885F2 10/4885
US-20180028510-A1 PREVENTION AND TREATMENT OF THROMBOSIS IN MEDICALLY ILL PATIENTS SERPINC1, TBXA2R, PLAT F10 37/4885KCNH2 2677/4885F2 12/4885
US-20160101089-A1 NOVEL PHARMACEUTICAL SALTS AND POLYMORPHS OF A FACTOR XA INHIBITOR F12, F11, TFPI F10 10/4885KCNH2 3549/4885F2 7/4885
US-20110033459-A1 COMBINATION THERAPY WITH A COMPOUND ACTING AS A PLATELET ADP RECEPTOR INHIBITOR MPL, P2RY4, P2RY1 F10 472/4885KCNH2 958/4885F2 343/4885

“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.