SCHEMBL7418243

SCHEMBL7418243

O=c1c2ccccc2ncn1CCCCN1CC=C(c2c[nH]c3ccc(F)cc23)CC1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.67
HTR1A P08908 2/20 0.67
SLC6A4 P31645 2/20 0.67
HTR7 P34969 2/20 0.67
HTR6 P50406 2/20 0.67
DRD4 P21917 1/20 0.67
HTR2A P28223 1/20 0.67
HTR2C P28335 1/20 0.67
DRD3 P35462 1/20 0.67
HTR2B P41595 1/20 0.67

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
SCHEMBL4865544 0.88 DRD2 (0.59) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL4867310 0.85 HTR1A (0.62) DRD2HTR1ASLC6A4HTR6HTR2A
SCHEMBL4872356 0.85 DRD2 (0.58) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL4862051 0.82 DRD2 (0.59) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL4869010 0.81 HTR1A (0.55) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL1040205 0.81 DRD2 (1.00) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL4873344 0.80 DRD2 (0.56) DRD2HTR1ASLC6A4HTR2A
SCHEMBL793141 0.79 DRD2 (1.00) DRD2HTR1ASLC6A4HTR7HTR6
SCHEMBL4872140 0.79 DRD2 (0.54) DRD2HTR1ASLC6A4HTR2A
SCHEMBL790948 0.78 DRD2 (0.72) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200072-A2 METHOD OF TREATING PSYCHOTIC DISORDERS Solvay Pharmaceuticals B.V. (NL) 2002-05-02 EP disclosed
WO-2000069424-A2 METHOD OF TREATING PSYCHOTIC DISORDERS SOLVAY PHARMACEUTICALS B.V. (NL) 2000-11-23 WO disclosed