SCHEMBL10634697

SCHEMBL10634697

CC(C)CN1CCO[C@H](COc2cccc3c2NCCC3)C1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 11/20 0.44
HRH3 Q9Y5N1 3/20 0.43

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
SCHEMBL10634689 1.00 DRD4 (0.44) DRD4HRH3
SCHEMBL10630048 0.89 DRD4 (0.46) DRD4HRH3
SCHEMBL10630054 0.89 DRD4 (0.46) DRD4HRH3
SCHEMBL10630155 0.87 DRD4 (0.47) DRD4
SCHEMBL10630160 0.87 DRD4 (0.47) DRD4
SCHEMBL9528172 0.86 HRH3 (0.60) DRD4HRH3
SCHEMBL9528170 0.86 HRH3 (0.60) DRD4HRH3
SCHEMBL9528279 0.85 DRD4 (0.42) DRD4
SCHEMBL9528287 0.85 DRD4 (0.42) DRD4
SCHEMBL10629334 0.85 HRH3 (0.43) DRD4HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4782054-A ANTIISCHEMIC, ANTIHYPOXIC, STIMULANTS ADIR ET COMPAGNIE (FR) 1988-11-01 US disclosed