SCHEMBL7701996

SCHEMBL7701996

Fc1cc2c(C3=CCN(CCCCCCC4CCc5ccccc54)CC3)c[nH]c2cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 12/20 0.49
HTR1A P08908 3/20 0.48
SLC6A4 P31645 3/20 0.48
HTR7 P34969 3/20 0.48
HTR6 P50406 3/20 0.48
DRD4 P21917 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
DRD3 P35462 1/20 0.48
HTR2B P41595 1/20 0.48

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
SCHEMBL7214328 0.88 DRD2 (0.65) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL7215170 0.87 DRD2 (0.64) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL7214030 0.87 DRD2 (0.54) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL7220408 0.84 DRD2 (0.53) DRD2HTR1ASLC6A4HTR7HTR6
Oxalic Acid SCHEMBL7214504 0.83 HTR1D (0.54) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL7214517 0.81 DRD2 (0.60) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL7213620 0.81 HTR1D (0.56) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL7513552 0.75 HTR1D (0.49) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL7213744 0.73 DRD2 (0.56) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL7213683 0.73 DRD2 (0.57) DRD2HTR1ASLC6A4HTR7HTR6

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-6352988-B2 HIGH AFFINITY FOR D4 RECEPTORS; TREATMENT OF SCHIZOPHRENIA, OTHER PSYCHOSES, ANXIETY DISORDERS, DEPRESSION, ALCOHOL ABUSE, IMPULSE CONTROL DISORDERS, AGGRESSION H. LUNDBECK A/S (DK) 2002-03-05 US disclosed