SCHEMBL6977304

SCHEMBL6977304

CCCC[N]N(C(C)C)C1CCCC1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 3/20 0.32
ADH1C P00326 2/20 0.32
ADH1B P00325 1/20 0.32
CYP1A2 P05177 1/20 0.32
SIGMAR1 Q99720 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
SCHEMBL6962435 0.98 CYP1A2 (0.35) ADH1AADH1CADH1BCYP1A2SIGMAR1
SCHEMBL6966739 0.92 ADH1C (0.32) ADH1AADH1C
SCHEMBL6971504 0.89 ADH1A (0.34) ADH1AADH1CADH1B
SCHEMBL6962180 0.87 ADH1A (0.37) ADH1AADH1CADH1B
SCHEMBL6975303 0.80
SCHEMBL6968025 0.80 ADH1A (0.36) ADH1AADH1CADH1B
SCHEMBL6974807 0.79 ADH1A (0.39) ADH1AADH1CADH1B
SCHEMBL6974471 0.73 CYP1A2 (0.34) ADH1AADH1CCYP1A2SIGMAR1
SCHEMBL6963743 0.73 ADH1A (0.37) ADH1AADH1CCYP1A2SIGMAR1
SCHEMBL6975732 0.72 ADH1A (0.39) ADH1AADH1CCYP1A2SIGMAR1

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