SCHEMBL8304293

SCHEMBL8304293

c1cc2c(c(N3CCN(CCc4cccc5ccccc45)CC3)c1)OCCO2

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.70
HTR1A P08908 1/20 0.61

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
SCHEMBL6611400 0.83 DRD2 (0.66) DRD2HTR1A
SCHEMBL6589414 0.82 DRD2 (1.00) DRD2HTR1A
SCHEMBL9143202 0.82 DRD2 (0.65) DRD2HTR1A
SCHEMBL7817070 0.81 HTR1A (0.59) DRD2HTR1A
SCHEMBL8307038 0.81 HTR1A (0.64) DRD2HTR1A
SCHEMBL8304288 0.79 ADRA1D (0.49) DRD2HTR1A
SCHEMBL6610101 0.78 DRD2 (0.60) DRD2HTR1A
SCHEMBL6589502 0.78 DRD2 (0.60) DRD2HTR1A
SCHEMBL6592915 0.78 DRD2 (0.60) DRD2HTR1A
SCHEMBL9179344 0.78 DRD2 (0.57) DRD2HTR1A

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 6 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 claimed
US-5464834-A Antidepressants, central nervous system ADIR ET COMPAGNIE (FR) 1995-11-07 US claimed
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 claimed
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