SCHEMBL1160974

SCHEMBL1160974

O=C1c2ccccc2C(=O)N1C[C@H]1CN(c2ccccc2N2CCOCC2=O)C(=O)O1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.54
CYP1A2 P05177 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
ABCB11 O95342 1/20 0.40
F2 P00734 1/20 0.40
ST14 Q9Y5Y6 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL29446947 0.89 F10 (0.66) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL15065018 0.89 F10 (0.66) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL30146333 0.89 F10 (0.66) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL78772 0.89 F10 (0.66) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL460444 0.89 F10 (0.66) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL29651806 0.89 F10 (0.66) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL2994083 0.85 F10 (0.53) F10
SCHEMBL15319214 0.83 F10 (0.75) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL15857655 0.83 F10 (0.56) F10CYP1A2CYP2C9CYP2C19CYP3A4
SCHEMBL19338281 0.83 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013098833-A2 PROCESSES AND INTERMEDIATES FOR PREPARING RIVAROXABAN CADILA HEALTHCARE LIMITED (IN) 2013-07-04 WO claimed
EP-2459555-B1 PROCESSES FOR CRYSTALLIZATION OF RIVAROXABAN KRKA D D NOVO MESTO (SI) 2021-11-03 EP disclosed
US-20140378682-A1 PROCESSES AND INTERMEDIATES FOR PREPARING RIVAROXABAN CADILA HEALTHCARE LIMITED (IN) 2014-12-25 US disclosed
WO-2013098833-A2 PROCESSES AND INTERMEDIATES FOR PREPARING RIVAROXABAN CADILA HEALTHCARE LIMITED (IN) 2013-07-04 WO disclosed
EP-2459555-A1 PROCESSES FOR CRYSTALLIZATION OF RIVAROXABAN KRKA, D.D., Novo Mesto (SI) 2012-06-06 EP 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.