SCHEMBL11236713

SCHEMBL11236713

O=Cc1ccccc1C1(O)CC2CCC(C1)N2CCCC(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.49
HTR1A P08908 8/20 0.49
HTR2A P28223 8/20 0.49
HRH1 P35367 8/20 0.49
DRD4 P21917 5/20 0.49
SLC18A3 Q16572 1/20 0.47
DRD3 P35462 8/20 0.41
SLC6A3 Q01959 7/20 0.41
SLC6A4 P31645 6/20 0.41
SLC6A2 P23975 6/20 0.41
HTR2B P41595 4/20 0.41
HTR2C P28335 3/20 0.41
ADRA2A P08913 2/20 0.41
ADRA2B P18089 2/20 0.41
ADRA2C P18825 2/20 0.41
ADRA1A P35348 2/20 0.41
DRD1 P21728 2/20 0.41
CHRM1 P11229 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL11245054 0.83 SLC18A3 (0.43) DRD2HTR1AHTR2AHRH1DRD4
SCHEMBL11236719 0.78 DRD2 (0.53) DRD2HTR1AHTR2AHRH1DRD4
SCHEMBL11236973 0.73 SLC18A3 (0.51) DRD2HTR1AHTR2AHRH1DRD4
SCHEMBL11241625 0.70 SLC18A3 (0.47) DRD2HTR1AHTR2AHRH1DRD4
SCHEMBL904855 0.63 OPRL1 (0.69) DRD2HTR1AHTR2AHRH1DRD4
SCHEMBL9053117 0.63 DRD2 (0.77) DRD2HTR1AHTR2AHRH1DRD4
SCHEMBL1206358 0.61 DRD2 (0.78) DRD2HTR1AHTR2AHRH1DRD4
SCHEMBL4283782 0.61 HTR2A (0.47) DRD2HTR1AHTR2AHRH1DRD4
SCHEMBL4379525 0.61 DRD3 (0.58) DRD2HTR1AHTR2AHRH1DRD4
SCHEMBL12760839 0.61 LMNA (0.48) MEN1ALDH1A1LMNATSHROPRM1

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-4366154-A TRANQUILIZERS; PSYCHOLOGICAL DISORDERS SANDOZ, INC. (US) 1982-12-28 US claimed