SCHEMBL8303559

SCHEMBL8303559

c1cc2c(c(N3CCN(CCCCc4ccsc4)CC3)c1)OCCO2

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.74
DRD2 P14416 2/20 0.57

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
SCHEMBL8303204 0.97 HTR1A (0.69) HTR1ADRD2
SCHEMBL8303876 0.92 HTR1A (0.61) HTR1ADRD2
SCHEMBL8306501 0.85 HTR1A (0.63) HTR1ADRD2
SCHEMBL8303446 0.82 HTR1A (0.93) HTR1ADRD2
SCHEMBL8303555 0.80 HTR1A (0.47) HTR1ADRD2
SCHEMBL791806 0.79 HTR1A (0.72) HTR1A
SCHEMBL791040 0.78 HTR1A (0.70) HTR1A
SCHEMBL8303199 0.77 HTR1A (0.43) HTR1ADRD2
SCHEMBL8304638 0.76 HTR1A (0.61) HTR1ADRD2
SCHEMBL6173953 0.75 HTR1A (0.65) 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-0574313-B1 1,4-Disubstituted piperazines for the treatment of disorders of the central nervous system and neuro-endocrine disorders ADIR (FR) 1999-10-06 EP disclosed
US-5464834-A Antidepressants, central nervous system ADIR ET COMPAGNIE (FR) 1995-11-07 US disclosed
EP-0574313-A1 1,4-Disubstituted piperazines for the treatment of disorders of the central nervous system and neuro-endocrine disorders ADIR ET COMPAGNIE (FR) 1993-12-15 EP disclosed