SCHEMBL6963448

SCHEMBL6963448

CCCCN(C)[N]CCC

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.36
ALDH1A1 P00352 1/20 0.34
ALDH2 P05091 1/20 0.34
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA9 Q16790 1/20 0.30
LMNA P02545 1/20 0.30
TSHR P16473 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
SCHEMBL6963208 0.90 DNM1 (0.36) DNM1ALDH1A1ALDH2CA12CA1
SCHEMBL6974381 0.83
SCHEMBL6971336 0.81
SCHEMBL6965824 0.79 DNM1 (0.36) DNM1ALDH1A1ALDH2LMNATSHR
SCHEMBL1704328 0.76 CA12 (0.36) DNM1ALDH1A1ALDH2CA12CA1
SCHEMBL2426474 0.75
SCHEMBL6973642 0.72 CA12 (0.35) CA12CA1CA9TSHR
SCHEMBL6973884 0.72 CA12 (0.33) CA12CA1CA9
SCHEMBL16844219 0.70
SCHEMBL22113531 0.70

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