SCHEMBL9175474

SCHEMBL9175474

c1ccc2c(c1)CC(CCCN1CCN(c3cccc4c3OCCO4)CC1)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.65

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
SCHEMBL9178367 0.93 ALDH1A1 (0.64) HTR1A
SCHEMBL9179406 0.85 HTR1A (0.67) HTR1A
SCHEMBL9176472 0.85
SCHEMBL9180759 0.82 HTR1A (0.63) HTR1A
SCHEMBL1037297 0.81
SCHEMBL791040 0.80 HTR1A (0.70) HTR1A
SCHEMBL7240508 0.80 HTR1A (0.60) HTR1A
SCHEMBL8303446 0.80 HTR1A (0.93) HTR1A
SCHEMBL791806 0.79 HTR1A (0.72) HTR1A
SCHEMBL9183299 0.79 HTR1A (0.58) HTR1A

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 3 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
US-5194437-A Substituted with oxygen containing heterocycle, central nervous system disorders, neuroendocrine disorders ADIR ET COMPAGNIE (FR) 1993-03-16 US 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