SCHEMBL8086622

SCHEMBL8086622

COc1ccccc1N1CCN(CCCCOc2ccc(-c3cc4ccccn4c3)cc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 14/20 0.69
DRD3 P35462 14/20 0.69
LMNA P02545 2/20 0.64
HRH3 Q9Y5N1 1/20 0.64
ALDH1A1 P00352 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
MAPT P10636 1/20 0.64
NLRP1 Q9C000 1/20 0.64
SLC6A2 P23975 2/20 0.63
SLC6A4 P31645 2/20 0.63
ADRA1A P35348 1/20 0.62
DRD1 P21728 4/20 0.59
DRD4 P21917 4/20 0.59
HTR2A P28223 4/20 0.59

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
SCHEMBL8090037 0.97 DRD2 (0.68) DRD2DRD3LMNAHRH3ALDH1A1
Hydrochloric Acid SCHEMBL8086718 0.96 DRD2 (0.67) DRD2DRD3LMNAHRH3ALDH1A1
SCHEMBL8086604 0.94 DRD2 (0.61) DRD2DRD3LMNAHRH3ALDH1A1
Hydrochloric Acid SCHEMBL8078633 0.93 DRD2 (0.61) DRD2DRD3LMNAHRH3ALDH1A1
SCHEMBL3616642 0.83 DRD2 (0.72) DRD2DRD3LMNAALDH1A1SMN1; SMN2
SCHEMBL8086583 0.81 DRD2 (1.00) DRD2DRD3LMNAHRH3ALDH1A1
SCHEMBL4564398 0.79 DRD2 (0.66) DRD2DRD3LMNAALDH1A1SMN1; SMN2
SCHEMBL8086599 0.79 DRD3 (1.00) DRD2DRD3HRH3SLC6A2SLC6A4
SCHEMBL4295620 0.78 HRH3 (1.00) HRH3
SCHEMBL8091851 0.78 DRD2 (0.78) DRD2DRD3LMNAALDH1A1SMN1; SMN2

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
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
EP-0935599-A1 2-METHOXYPHENYLPIPERAZINE DERIVATIVES RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1999-08-18 EP disclosed
WO-1998018797-A1 2-METHOXYPHENYLPIPERAZINE DERIVATIVES Richter Gedeon Vegyészeti Gyár Rt. (HU) 1998-05-07 WO disclosed