SCHEMBL28042573

SCHEMBL28042573

CCOC(=O)c1ccc(C2CNCCO2)cc1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 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
SCHEMBL28274078 0.86
SCHEMBL29034253 0.85 TAAR1 (0.48) TAAR1
SCHEMBL31385851 0.85
SCHEMBL27805833 0.85
SCHEMBL28561245 0.82
SCHEMBL29318691 0.82 CYP2C9 (0.48) TAAR1
SCHEMBL4034565 0.80 TAAR1 (0.55) TAAR1
SCHEMBL15988123 0.80
SCHEMBL1499458 0.80 CA1 (0.56)
Ammonia Solution, Strong SCHEMBL28820910 0.79

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-106146493-A Pyrazolo [3,4-b] pyridines and the preparation method of indazole compounds and purposes 中国科学院上海药物研究所 2016-11-23 CN disclosed
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