SCHEMBL455793

SCHEMBL455793

NCC1CN(c2ccc(N3CCOCC3=O)cc2)C(=O)O1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 1.00
CYP1A2 P05177 2/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2D6 P10635 2/20 0.57
CYP2C9 P11712 2/20 0.57
CYP2C19 P33261 2/20 0.57
ABCB11 O95342 1/20 0.57
F2 P00734 1/20 0.57
ST14 Q9Y5Y6 1/20 0.57
CYP2J2 P51589 1/20 0.52

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
SCHEMBL87178 1.00 F10 (1.00) F10CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL15203246 1.00 F10 (1.00) F10CYP1A2CYP3A4CYP2D6CYP2C9
Hydrochloric Acid SCHEMBL792570 0.99 F10 (0.97) F10CYP1A2CYP3A4CYP2D6CYP2C9
Hydrochloric Acid SCHEMBL792571 0.99 F10 (0.97) F10CYP1A2CYP3A4CYP2D6CYP2C9
Sulfuric Acid SCHEMBL793039 0.94 F10 (0.88) F10CYP1A2CYP3A4CYP2D6CYP2C9
Sulfuric Acid SCHEMBL793040 0.94 F10 (0.88) F10CYP1A2CYP3A4CYP2D6CYP2C9
Oxalic Acid SCHEMBL14861652 0.94 F10 (0.88) F10CYP1A2CYP3A4CYP2D6CYP2C9
Acetic Acid SCHEMBL13737134 0.93 F10 (0.86) F10CYP1A2CYP3A4CYP2D6CYP2C9
Acetic Acid SCHEMBL13736179 0.93 F10 (0.86) F10CYP1A2CYP3A4CYP2D6CYP2C9
Acetic Acid SCHEMBL13738152 0.93 F10 (0.86) F10CYP1A2CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111265668-A Composition comprising a histamine release-promoting substance and an inhibitory compound 黄泳华 2020-06-12 CN claimed
CN-109232551-B Rivaroxaban isopropylidene impurity reference substance and preparation method thereof 东南大学 2020-06-02 CN claimed
CN-109232551-A Razaxaban isopropylidene impurity reference substance and preparation method thereof 东南大学 2019-01-18 CN claimed
US-20140378682-A1 PROCESSES AND INTERMEDIATES FOR PREPARING RIVAROXABAN CADILA HEALTHCARE LIMITED (IN) 2014-12-25 US claimed
WO-2013120465-A1 A PROCESS FOR THE PREPARATION OF RIVAROXABAN BASED ON THE USE OF (S)-EPICHLOROHYDRIN ZENTIVA, K.S. (CZ) 2013-08-22 WO 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-2013105100-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) 2013-07-18 WO claimed
EP-2613787-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) 2013-07-17 EP claimed
WO-2013098833-A2 PROCESSES AND INTERMEDIATES FOR PREPARING RIVAROXABAN CADILA HEALTHCARE LIMITED (IN) 2013-07-04 WO claimed
US-20130172554-A1 PROCESSES FOR THE PREPARATION OF 4-MORPHOLIN-3-ONE SYMED LABS LIMITED (IN) 2013-07-04 US claimed
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 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
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 claimed
EP-4552633-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING AMORPHOUS SOLID SOLUTIONS OF RIVAROXABAN AND COPOVIDONE AND PREPARATION METHODS THEREOF Zentiva K.S. (CZ) 2025-05-14 EP disclosed
CN-115536651-B Rivaroxad method for preparing class 陕西汉江药业集团股份有限公司 2025-03-18 CN disclosed
CN-115536651-A Preparation method of rivaroxaban 陕西汉江药业集团股份有限公司 2022-12-30 CN 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
US-20110288294-A1 Preparation process for an inhibitor of a blood clotting factor ARCHIMICA GMBH (DE) 2011-11-24 US disclosed
WO-2011080341-A1 PROCESS FOR THE PREPARATION OF RIVAROXABAN AND INTERMEDIATES THEREOF ENANTIA, S.L. (ES) 2011-07-07 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 (3 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-20110288294-A1 Preparation process for an inhibitor of a blood clotting factor TFPI, F5, F11 F10 10/4885CYP1A2 972/4885CYP3A4 484/4885
US-20130172554-A1 PROCESSES FOR THE PREPARATION OF 4-MORPHOLIN-3-ONE TYR, CYP1B1, AAAS F10 4199/4885CYP1A2 26/4885CYP3A4 7/4885
US-20140378682-A1 PROCESSES AND INTERMEDIATES FOR PREPARING RIVAROXABAN VKORC1, VKORC1L1, F2 F10 11/4885CYP1A2 16/4885CYP3A4 6/4885

“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.