SCHEMBL27923488

SCHEMBL27923488

O=C(Cl)c1ccc(N2CCOCC2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.51
F10 P00742 12/20 0.51
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49

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
SCHEMBL209054 0.86 ALDH1A1 (0.61) PTGS2F10ALDH1A1HPGD
SCHEMBL2639481 0.84 F10 (0.52) PTGS2F10ALDH1A1HPGD
SCHEMBL1678414 0.84 F10 (0.49) PTGS2F10ALDH1A1HPGD
SCHEMBL1627878 0.82 HPGD (0.54) PTGS2F10ALDH1A1HPGD
SCHEMBL27923490 0.81 HPGD (0.37) PTGS2F10ALDH1A1HPGD
SCHEMBL1626763 0.81 ALDH1A1 (0.54) PTGS2F10ALDH1A1HPGD
SCHEMBL19647445 0.81 F10 (0.62) PTGS2F10
SCHEMBL19086541 0.80 PTGS2 (0.64) PTGS2F10
SCHEMBL28956907 0.80 PTGS2 (0.67) PTGS2F10
SCHEMBL76558 0.78 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103360380-B A kind of synthetic method of razaxaban and the intermediate of razaxaban and preparation thereof ZHEJIANG TIANYU PHARMACEUTICAL CO., LTD. (CN) 2016-01-20 CN disclosed
CN-103360380-A Synthesis method of rivaroxaban, and rivaroxaban intermediate and preparation thereof ZHEJIANG TIANYU PHARMACEUTICAL CO LTD 2013-10-23 CN disclosed