SCHEMBL460444

SCHEMBL460444

O=C1c2ccccc2C(=O)N1CC1CN(c2ccc(N3CCOCC3=O)cc2)C(=O)O1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.66
CYP1A2 P05177 3/20 0.51
CYP2C9 P11712 3/20 0.51
CYP2C19 P33261 3/20 0.51
CYP3A4 P08684 2/20 0.51
CYP2D6 P10635 2/20 0.51
ABCB11 O95342 1/20 0.51
F2 P00734 1/20 0.51
ST14 Q9Y5Y6 1/20 0.51
CYP2J2 P51589 1/20 0.47
GRM2 Q14416 1/20 0.43
RPS6KA3 P51812 1/20 0.42
RPS6KA2 Q15349 1/20 0.42

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
SCHEMBL15065018 1.00 F10 (0.66) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL30146333 1.00 F10 (0.66) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL78772 1.00 F10 (0.66) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL29446947 1.00 F10 (0.66) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL29651806 1.00 F10 (0.66) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL15857655 0.92 F10 (0.56) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL11934594 0.89 F10 (0.52) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL1160974 0.89 F10 (0.54) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL2994083 0.87 F10 (0.53) F10
SCHEMBL19338281 0.85 F10 (0.51) F10CYP1A2CYP2C9CYP2C19CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140378682-A1 PROCESSES AND INTERMEDIATES FOR PREPARING RIVAROXABAN CADILA HEALTHCARE LIMITED (IN) 2014-12-25 US claimed
EP-2616466-A2 PROCESS FOR DETERMINING THE SUITABILITY FOR DISTRIBUTION OF A BATCH OF A THIOPHENE-2-CARBOXAMIDE DERIVATIVE Medichem, S.A. (ES) 2013-07-24 EP claimed
WO-2013098833-A2 PROCESSES AND INTERMEDIATES FOR PREPARING RIVAROXABAN CADILA HEALTHCARE LIMITED (IN) 2013-07-04 WO claimed
WO-2012035057-A2 PROCESS FOR DETERMINING THE SUITABILITY FOR DISTRIBUTION OF A BATCH OF A THIOPHENE-2-CARBOXAMIDE DERIVATIVE MEDICHEM S.A. (ES) 2012-03-22 WO claimed
EP-2459555-B1 PROCESSES FOR CRYSTALLIZATION OF RIVAROXABAN KRKA D D NOVO MESTO (SI) 2021-11-03 EP disclosed
WO-2019163731-A1 PRODUCTION METHOD FOR OXAZOLIDINONE COMPOUND 住友化学株式会社 2019-08-29 WO disclosed
EP-2705028-B1 PROCESS FOR THE PREPARATION OF A RIVAROXABAN AND INTERMEDIATES FORMED IN SAID PROCESS EGYT GYOGYSZERVEGYESZETI GYAR (HU) 2019-08-21 EP disclosed
US-9663505-B2 Process for the preparation of rivaroxaban GLENMARK PHARMACEUTICALS LIMITED (IN) 2017-05-30 US disclosed
US-9663505-B2 Process for the preparation of rivaroxaban GLENMARK PHARMACEUTICALS LIMITED (IN) 2017-05-30 US disclosed
CN-105085370-B (S)-1-halo-2-[2-(1,3-dioxo-isoindol)yl]ethyl chloroformate and preparation method thereof 北大方正集团有限公司 2017-04-12 CN disclosed
EP-2837628-B1 METHOD FOR PREPARING RIVAROXABAN INTERMEDIATE CHINA NAT MEDICINES GUORUI PHARMACEUTICAL CO LTD (CN) 2016-11-30 EP disclosed
WO-2015198259-A1 PROCESS FOR THE SYNTHESIS OF RIVAROXABAN AND INTERMEDIATE FOR THE PRODUCTION THEREOF ERREGIERRE S.P.A. (IT) 2015-12-30 WO disclosed
WO-2013098833-A2 PROCESSES AND INTERMEDIATES FOR PREPARING RIVAROXABAN CADILA HEALTHCARE LIMITED (IN) 2013-07-04 WO disclosed
WO-2013046211-A1 PROCESSES FOR THE PREPARATION OF 5-CHLORO-N-({(5S)-2-OXO-3-[4-(3-OXO-4-MORPHOLINYL) PHENYL]-1,3-OXAZOLIDIN-5-YL}METHYL)-2-THIOPHENE-CARBOXAMIDE AND INTERMEDIATES THEREOF SYMED LABS LIMITED (IN) 2013-04-04 WO disclosed
WO-2013027225-A1 PROCESSES FOR THE PREPARATION OF 4-{4-[5(S)-(AMINOMETHYL)-2-OXO-1,3-OXAZOLIDIN-3-YL]PHENYL} MORPHOLIN-3-ONE SYMED LABS LIMITED (IN) 2013-02-28 WO disclosed
EP-2459555-A1 PROCESSES FOR CRYSTALLIZATION OF RIVAROXABAN KRKA, D.D., Novo Mesto (SI) 2012-06-06 EP disclosed
WO-2012035057-A2 PROCESS FOR DETERMINING THE SUITABILITY FOR DISTRIBUTION OF A BATCH OF A THIOPHENE-2-CARBOXAMIDE DERIVATIVE MEDICHEM S.A. (ES) 2012-03-22 WO disclosed
WO-2012032533-A2 PROCESSES FOR THE PREPARATION OF 4-{4-[5(S)-(AMINOMETHYL)-2-OXO-1,3-OXAZOLIDIN-3-YL]PHENYL} MORPHOLIN-3-ONE SYMED LABS LIMITED (IN) 2012-03-15 WO disclosed
WO-2012032533-A2 PROCESSES FOR THE PREPARATION OF 4-{4-[5(S)-(AMINOMETHYL)-2-OXO-1,3-OXAZOLIDIN-3-YL]PHENYL} MORPHOLIN-3-ONE SYMED LABS LIMITED (IN) 2012-03-15 WO disclosed
WO-2011012321-A1 PROCESSES FOR CRYSTALLIZATION OF RIVAROXABAN KRKA, D.D., NOVO MESTO (SI) 2011-02-03 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-20140378682-A1 PROCESSES AND INTERMEDIATES FOR PREPARING RIVAROXABAN VKORC1, VKORC1L1, F2 F10 11/4885CYP1A2 16/4885CYP2C9 7/4885

“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.