SCHEMBL9182190

SCHEMBL9182190

c1ccc2c(c1)CC2CN1CCN(c2cccc3c2OCCO3)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.60

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
SCHEMBL9174181 0.90
SCHEMBL1037297 0.88
SCHEMBL9176472 0.86
SCHEMBL9180759 0.85 HTR1A (0.63) HTR1A
SCHEMBL9179406 0.84 HTR1A (0.67) HTR1A
SCHEMBL9173735 0.83 HTR1A (0.43) HTR1A
SCHEMBL9466874 0.83 HTR1A (0.43) HTR1A
SCHEMBL9173732 0.83 HTR1A (0.43) HTR1A
SCHEMBL9176539 0.83
SCHEMBL9174162 0.83

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