SCHEMBL6438428

SCHEMBL6438428

CC(C)(Cc1ccoc1)N=C=O

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.37
CETP P11597 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.30

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
SCHEMBL27559156 0.79 SLC6A2 (0.39)
SCHEMBL11785888 0.74 SLC6A2 (0.52)
SCHEMBL5962327 0.73 ESR1 (0.43) ALOX5CETP
SCHEMBL11786125 0.73 CYP2A6 (0.36)
SCHEMBL30480110 0.73 ATM (0.37)
SCHEMBL9718076 0.71 IDO1 (0.39)
SCHEMBL19041517 0.70 ESR1 (0.36)
SCHEMBL5166148 0.70 CYP3A4 (0.55)
SCHEMBL4842726 0.69 PYCR1 (0.39)
SCHEMBL6436472 0.68 ALOX5 (0.42) ALOX5CETPTRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1250528-C Cyclic nitrones and pharmaceutical compositions containing them AWENTIS PHARMACEUTICAL INC (US) 2006-04-12 CN disclosed
EP-1288203-B1 Cyclic nitrones and pharmaceutical compositions containing them AVENTIS PHARMA INC (US) 2005-04-20 EP disclosed
CN-1500779-A Cyclic nitrones and pharmaceutical compositions containing them ���µ�˹ҩ�﹫˾ 2004-06-02 CN disclosed
CN-1500787-A Cyclic nitrones and pharmaceutical compositions containing them ���µ�˹ҩ�﹫˾ 2004-06-02 CN disclosed
EP-1288203-A1 Cyclic nitrones and pharmaceutical compositions containing them Aventis Pharmaceuticals Inc. (US) 2003-03-05 EP disclosed
US-5962469-A PREVENTION OF OXIDATION TISSUE DAMAGE BY FREE RADICALS HOECHST MARION ROUSSEL INC. (US) 1999-10-05 US disclosed
CN-1196050-A Cyclic nitrones and pharmaceutical compositions containing them HOECHST MARION ROUSSEL INC (US) 1998-10-14 CN disclosed
EP-0863878-A1 CYCLIC NITRONES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM HOECHST MARION ROUSSEL, INC. (US) 1998-09-16 EP disclosed
WO-1997010218-A1 CYCLIC NITRONES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM HOECHST MARION ROUSSEL, INC. (US) 1997-03-20 WO disclosed