SCHEMBL6965161

SCHEMBL6965161

CCCN([N]CC)C1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 3/20 0.44
ADH1C P00326 2/20 0.44
CYP1A2 P05177 1/20 0.32
HTR1A P08908 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
SCHEMBL6972470 0.98 ADH1A (0.46) ADH1AADH1CCYP1A2
SCHEMBL6968469 0.91 ADH1A (0.35) ADH1AADH1CHTR1A
SCHEMBL6966061 0.89 ADH1A (0.38) ADH1AADH1CCYP1A2
SCHEMBL6975311 0.88 ADH1A (0.40) ADH1AADH1CCYP1A2
SCHEMBL6966972 0.85 ADH1A (0.42) ADH1AADH1CCYP1A2
SCHEMBL6974938 0.83 ADH1A (0.44) ADH1AADH1CCYP1A2
SCHEMBL6974972 0.82 ADH1A (0.39) ADH1AADH1C
SCHEMBL6968931 0.80 ADH1A (0.42) ADH1AADH1C
SCHEMBL6969148 0.80 ADH1C (0.38) ADH1AADH1C
SCHEMBL6968181 0.76 ADH1A (0.34) ADH1AADH1C

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
EP-0870765-B1 AMINOTHIAZOLE DERIVATIVES, DRUG CONTAINING THE SAME AND INTERMEDIATE IN THE PRODUCTION OF THE COMPOUNDS ZERIA PHARM CO LTD (JP) 2003-11-19 EP disclosed
US-5981557-A HAVING IMPROVING EFFECTS ON THE DYSMOTILITY IN THE GASTROINTESTINAL TRACT ZERIA PHARMACEUTICAL CO., LTD. (JP) 1999-11-09 US disclosed
EP-0870765-A1 AMINOTHIAZOLE DERIVATIVES, DRUG CONTAINING THE SAME AND INTERMEDIATE IN THE PRODUCTION OF THE COMPOUNDS ZERIA PHARMACEUTICAL CO., LTD. (JP) 1998-10-14 EP disclosed