SCHEMBL18716539

SCHEMBL18716539

CC(C)(C)NC(=O)CN1C2CCC1CC(C/C=N/c1cccc3c1OCCO3)C2

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 20/20 0.49

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
SCHEMBL19082638 0.79 CACNA1H (0.65) CACNA1H
SCHEMBL19082665 0.71 CACNA1H (0.68) CACNA1H
SCHEMBL18716582 0.71 CACNA1H (0.68) CACNA1H
SCHEMBL19082657 0.71 CACNA1H (0.68) CACNA1H
SCHEMBL19082674 0.69 CACNA1H (0.66) CACNA1H
SCHEMBL19082635 0.68 CACNA1H (0.75) CACNA1H
SCHEMBL19082649 0.67 CACNA1H (0.90) CACNA1H
SCHEMBL19082634 0.66 CACNA1H (1.00) CACNA1H
Hydrochloric Acid SCHEMBL18686586 0.65 CACNA1H (0.67) CACNA1H
SCHEMBL18686491 0.65 CACNA1H (0.71) CACNA1H

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3150598-B1 SUBSTITUTED TROPANE DERIVATIVES TOA EIYO LTD (JP) 2019-02-13 EP disclosed
EP-3150598-A1 SUBSTITUTED TROPANE DERIVATIVES TOA Eiyo Ltd. (JP) 2017-04-05 EP disclosed