SCHEMBL9851528

SCHEMBL9851528

CCCN(CC1CCN(C(=O)c2ccccc2)CC1)C1CCc2ccccc2C1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.57
DRD3 P35462 5/20 0.50
DRD2 P14416 2/20 0.50

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
SCHEMBL9851511 0.94 DRD3 (0.51) HTR1ADRD3
SCHEMBL9851530 0.85 ACHE (0.48)
SCHEMBL9493745 0.82 MEN1 (0.48)
SCHEMBL9851536 0.80 ACHE (0.52)
SCHEMBL30783001 0.80 DRD2 (0.58) DRD3DRD2
SCHEMBL31208124 0.79 DRD2 (0.59) HTR1ADRD3DRD2
SCHEMBL31208089 0.79 DRD2 (0.59) HTR1ADRD3DRD2
SCHEMBL31208109 0.79 DRD2 (0.59) HTR1ADRD3DRD2
Hydrochloric Acid SCHEMBL31622996 0.79 DRD2 (0.57) DRD3DRD2
SCHEMBL31208084 0.79 DRD2 (0.57) HTR1ADRD3DRD2

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
EP-0447292-A1 4-Aminomethyl-piperidine derivatives, their preparation and therapeutic application SYNTHELABO (FR) 1991-09-18 EP disclosed