SCHEMBL6967475

SCHEMBL6967475

CCCN(C[NH])C1CCCC1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 3/20 0.45
ADH1C P00326 2/20 0.45
DRD3 P35462 8/20 0.38
DRD2 P14416 5/20 0.38
DRD4 P21917 4/20 0.38
HTR1A P08908 1/20 0.34
FYN P06241 3/20 0.33

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
SCHEMBL6971631 0.98 ADH1A (0.47) ADH1AADH1CDRD3DRD2DRD4
SCHEMBL6964054 0.91
SCHEMBL6974139 0.87 ADH1A (0.38) ADH1AADH1CDRD3DRD2DRD4
SCHEMBL516016 0.85 ADH1A (0.52) ADH1AADH1CDRD3DRD2DRD4
SCHEMBL6967850 0.85 ADH1A (0.40) ADH1AADH1CDRD3DRD2DRD4
SCHEMBL516269 0.83 ADH1A (0.54) ADH1AADH1CDRD3DRD2DRD4
SCHEMBL11073680 0.83 ADH1A (0.54) ADH1AADH1CDRD3DRD2DRD4
SCHEMBL22541111 0.83 ADH1A (0.54) ADH1AADH1CDRD3DRD2DRD4
SCHEMBL15865807 0.83 DRD3 (0.48) ADH1AADH1CDRD3DRD2DRD4
SCHEMBL3373144 0.81 ADH1A (0.48) ADH1AADH1CDRD3DRD2DRD4

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