SCHEMBL28005757

SCHEMBL28005757

O=C1COCCN1c1ccc(N[N+](=O)[O-])cc1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 15/20 0.54
F10 P00742 5/20 0.47

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
SCHEMBL78624 0.81 MAPT (0.51) PTGS2F10
Hydrochloric Acid SCHEMBL27883894 0.79 MAPT (0.50) PTGS2F10
SCHEMBL28249837 0.79 PTGS2 (0.59) PTGS2F10
SCHEMBL13890608 0.79 PTGS2 (0.59) PTGS2F10
SCHEMBL15084215 0.79 PTGS2 (0.63) PTGS2F10
SCHEMBL8270081 0.77 PTGS2 (0.56) PTGS2F10
SCHEMBL8270052 0.75 F10 (0.57) PTGS2F10
SCHEMBL8268511 0.75 PTGS2 (0.55) PTGS2F10
SCHEMBL118847 0.75 F10 (0.60) PTGS2F10
SCHEMBL76558 0.75 F10 (0.58) PTGS2F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104478820-B A kind of preparation method of Rivaroxaban intermediate 杭州瀚康生物医药科技有限公司 2016-08-31 CN disclosed
CN-105111163-A Synthesis method of 4-(4-aminophenyl)-3-morpholone ZHEJIANG CHARIOTEER PHARMACEUTICAL CO LTD 2015-12-02 CN disclosed
CN-104478820-A Preparation method of rivaroxabanintermediate HANCHEM BIOPHARM TECH CO LTD 2015-04-01 CN disclosed