SCHEMBL2178470

SCHEMBL2178470

O=C(Nc1ccc(N2CCOCC2=O)cc1)OCc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.73
PRKDC P78527 1/20 0.54
PTGS2 P35354 4/20 0.51
POLB P06746 1/20 0.49
KDM1A O60341 1/20 0.48
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
NPC1 O15118 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
TSHR P16473 1/20 0.48
RAB9A P51151 1/20 0.48
ATM Q13315 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL19186610 0.84 F10 (1.00) F10PRKDCPTGS2KDM1AMAOA
SCHEMBL78438 0.83 SMN1; SMN2 (0.67) F10PRKDCPOLBKDM1AMAOA
SCHEMBL25207144 0.83 GAA (0.56) F10PTGS2ALDH1A1MAPT
SCHEMBL78639 0.83 F10 (0.59) F10POLBKDM1AMAOAMAOB
SCHEMBL12809180 0.81 F10 (0.53) F10PTGS2
SCHEMBL4490031 0.81 F10 (0.53) F10PTGS2
SCHEMBL1405994 0.81 F10 (0.53) F10PTGS2
SCHEMBL15195101 0.81 F10 (0.53) F10PTGS2NPC1MAPTRAB9A
SCHEMBL15200539 0.81 F10 (0.56) F10PTGS2NPC1MAPTRAB9A
SCHEMBL118728 0.81 F10 (0.58) F10PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-8648189-B2 Method for the preparation of rivoraxaban SANDOZ AG (CH) 2014-02-11 US disclosed
US-8648189-B2 Method for the preparation of rivoraxaban SANDOZ AG (CH) 2014-02-11 US disclosed
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 disclosed
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 disclosed
US-20130184457-A1 METHOD FOR THE PREPARATION OF RIVORAXABAN SANDOZ AG (CH) 2013-07-18 US disclosed
US-20130184457-A1 METHOD FOR THE PREPARATION OF RIVORAXABAN SANDOZ AG (CH) 2013-07-18 US disclosed
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 disclosed
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 disclosed
EP-2521717-B1 Method for the preparation of rivaroxaban SANDOZ AG (CH) 2013-05-22 EP disclosed
EP-2521717-A1 METHOD FOR THE PREPARATION OF RIVAROXABAN Sandoz AG (CH) 2012-11-14 EP disclosed
EP-2521723-A1 PROCESS FOR THE PREPARATION OF RIVAROXABAN AND INTERMEDIATES THEREOF Enantia, S.L. (ES) 2012-11-14 EP disclosed
US-20120283434-A1 PROCESS FOR THE PREPARATION OF RIVAROXABAN AND INTERMEDIATES THEREOF ENANTIA, S.L. (ES) 2012-11-08 US disclosed
US-20120283434-A1 PROCESS FOR THE PREPARATION OF RIVAROXABAN AND INTERMEDIATES THEREOF ENANTIA, S.L. (ES) 2012-11-08 US disclosed
WO-2011098501-A1 METHOD FOR THE PREPARATION OF RIVAROXABAN SANDOZ AG (CH) 2011-08-18 WO disclosed
WO-2011098501-A1 METHOD FOR THE PREPARATION OF RIVAROXABAN SANDOZ AG (CH) 2011-08-18 WO disclosed
EP-2354128-A1 Method for the preparation of rivaroxaban SANDOZ AG (CH) 2011-08-10 EP disclosed
EP-2354128-A1 Method for the preparation of rivaroxaban SANDOZ AG (CH) 2011-08-10 EP disclosed
WO-2011080341-A1 PROCESS FOR THE PREPARATION OF RIVAROXABAN AND INTERMEDIATES THEREOF ENANTIA, S.L. (ES) 2011-07-07 WO disclosed
WO-2011080341-A1 PROCESS FOR THE PREPARATION OF RIVAROXABAN AND INTERMEDIATES THEREOF ENANTIA, S.L. (ES) 2011-07-07 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 (2 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-20130184457-A1 METHOD FOR THE PREPARATION OF RIVORAXABAN VKORC1, VKORC1L1, CYP3A5 F10 49/4885PRKDC 3733/4885PTGS2 286/4885
US-20120283434-A1 PROCESS FOR THE PREPARATION OF RIVAROXABAN AND INTERMEDIATES THEREOF F12, VKORC1, CYP2C9 F10 4/4885PRKDC 4151/4885PTGS2 3396/4885

“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.