SCHEMBL8085582

SCHEMBL8085582

COc1ccccc1N1CCN(CCCCOc2ccc(-c3cn4ccsc4n3)cc2)CC1

nearest known ligand 0.74

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 14/20 0.74
DRD3 P35462 14/20 0.74
HTR1A P08908 1/20 0.60
HTR7 P34969 1/20 0.60
LMNA P02545 2/20 0.59
ALDH1A1 P00352 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
MAPT P10636 1/20 0.59
NLRP1 Q9C000 1/20 0.59
SLC6A2 P23975 1/20 0.58
SLC6A4 P31645 1/20 0.58
ADRA1A P35348 1/20 0.57
DRD4 P21917 2/20 0.56
DRD1 P21728 1/20 0.55
HTR2A P28223 1/20 0.55

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
SCHEMBL29608207 1.00 DRD2 (0.74) DRD2DRD3HTR1AHTR7LMNA
Hydrochloric Acid SCHEMBL8091856 0.99 DRD2 (0.73) DRD2DRD3HTR1AHTR7LMNA
SCHEMBL8085595 0.97 DRD2 (0.73) DRD2DRD3HTR1AHTR7LMNA
SCHEMBL8085463 0.95 DRD2 (0.67) DRD2DRD3HTR1AHTR7LMNA
Hydrochloric Acid SCHEMBL8091842 0.94 DRD2 (0.66) DRD2DRD3HTR1AHTR7LMNA
SCHEMBL29543927 0.88 DRD3 (0.56) DRD2DRD3HTR1AHTR7
SCHEMBL8086583 0.85 DRD2 (1.00) DRD2DRD3HTR1AHTR7LMNA
SCHEMBL8091851 0.83 DRD2 (0.78) DRD2DRD3HTR1AHTR7LMNA
SCHEMBL8086599 0.82 DRD3 (1.00) DRD2DRD3HTR1AHTR7SLC6A2
SCHEMBL8078634 0.81 DRD2 (0.77) DRD2DRD3HTR1AHTR7LMNA

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-6103724-A EXHIBIT MAINLY ANTIPSYCHOTIC EFFECTS, E.G., SCHIZOPHRENIA, ORGANIC MENTAL DISORDERS, AFFECTIVE DISORDERS, ANXIETY, PERSONALITY DISORDERS; NEUROLEPTIC ACTIVITIY; ATYPICAL ANTIPSYCHOTICS, COGNITION ACTIVATORS, ANTIDEPRESSANTS; RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2000-08-15 US disclosed