SCHEMBL9722202

SCHEMBL9722202

c1ccc2c(c1)CC(CN1CCN(c3nsc4ccccc34)CC1)C2

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.59
HTR2A P28223 4/20 0.59
HTR1A P08908 3/20 0.59
DRD3 P35462 3/20 0.59
KDM4E B2RXH2 1/20 0.53
MAPT P10636 1/20 0.53
ADRA2C P18825 2/20 0.53
ABCB11 O95342 1/20 0.53
CHRM2 P08172 1/20 0.53
ADRA2A P08913 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
ADRA2B P18089 1/20 0.53
DRD1 P21728 1/20 0.53
TBXA2R P21731 1/20 0.53
ACHE P22303 1/20 0.53
SLC6A2 P23975 1/20 0.53
PDE4A P27815 1/20 0.53
HTR2C P28335 1/20 0.53
CCKAR P32238 1/20 0.53
HTR7 P34969 1/20 0.53

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
SCHEMBL10845187 0.89 DRD2 (0.68) DRD2HTR2AHTR1ADRD3KDM4E
SCHEMBL9184054 0.86 HTR2A (0.52) DRD2HTR2AHTR1ADRD3HTR2C
SCHEMBL12841339 0.86 DRD2 (0.61) DRD2HTR2AHTR1ADRD3KDM4E
SCHEMBL9722367 0.85 DRD2 (0.52) DRD2HTR2AHTR1ADRD3KDM4E
Hydrochloric Acid SCHEMBL9722283 0.84 KDM4E (0.51) DRD2HTR2AHTR1ADRD3KDM4E
SCHEMBL22302285 0.84 DRD2 (0.79) DRD2HTR2AHTR1ADRD3ADRA2C
SCHEMBL9722267 0.82 DRD2 (0.49) DRD2HTR2AHTR1ADRD3ADRA2C
SCHEMBL9680146 0.81 KDM4E (0.56) DRD2HTR2AHTR1ADRD3KDM4E
SCHEMBL9722279 0.81 DRD2 (0.58) DRD2HTR2AHTR1ADRD3ADRA2C
SCHEMBL9722272 0.81 DRD2 (0.58) DRD2HTR2AHTR1ADRD3ADRA2C

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
US-5173490-A Antipsychotic drugs having no side effects; anxiolytic agents; analgesics; tranquilizers; sedatives; antidepressants ADIR ET COMPAGNIE (FR) 1992-12-22 US disclosed