SCHEMBL9180804

SCHEMBL9180804

Clc1cccc2c1CC2CCN1CCN(c2cccc3c2CCOO3)CC1

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.40

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
SCHEMBL9177692 1.00 DRD2 (0.40) DRD2
SCHEMBL9466287 0.94 DRD4 (0.43) DRD2
SCHEMBL9179801 0.94 DRD4 (0.43) DRD2
SCHEMBL9174152 0.90 HTR2C (0.37) DRD2
SCHEMBL9466380 0.90 HTR2C (0.37) DRD2
SCHEMBL1037294 0.85
SCHEMBL9178238 0.85
SCHEMBL9466843 0.84 HTR7 (0.38) DRD2
SCHEMBL1038532 0.82 HTR2C (0.44)
SCHEMBL9175625 0.82 HTR2C (0.44)

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-0490772-B1 1,4-Disubstituted piperazines, their process of preparation and pharmaceutical compositions containing them ADIR (FR) 1995-07-26 EP disclosed
EP-0490772-A1 1,4-Disubstituted piperazines, their process of preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-06-17 EP disclosed