SCHEMBL6970324

SCHEMBL6970324

CCC[N]N(CC)CCC

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31

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
SCHEMBL1793940 0.88 CA12 (0.33) CA12CA1CA2CA9
SCHEMBL838600 0.85
SCHEMBL6973642 0.84 CA12 (0.35) TSHRCA12CA1CA2CA9
SCHEMBL6968769 0.84 TSHR (0.32) TSHRCA12CA1CA2CA9
SCHEMBL6974455 0.80
SCHEMBL6973884 0.79 CA12 (0.33) CA12CA1CA2CA9
SCHEMBL6975507 0.74 CA12 (0.35) TSHRCA12CA1CA2CA9
SCHEMBL1704328 0.72 CA12 (0.36) TSHRCA12CA1CA2CA9
SCHEMBL7472255 0.72 DNM1 (0.32) TSHRCA12CA1CA2CA9
SCHEMBL8566874 0.70 MAPT (0.35)

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