SCHEMBL7327249

SCHEMBL7327249

Fc1ccc(C(CCCN2CCN(CCSc3ccc(Cl)cc3)CC2)c2ccc(F)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.61
DRD3 P35462 8/20 0.61
HTR1A P08908 6/20 0.61
HTR2A P28223 6/20 0.61
DRD5 P21918 4/20 0.61
DRD1 P21728 2/20 0.61
HRH1 P35367 4/20 0.57
HTR2C P28335 2/20 0.57
HTR7 P34969 3/20 0.54
SLC6A3 Q01959 3/20 0.54
SLC6A2 P23975 1/20 0.54
SLC6A4 P31645 1/20 0.54
HTR2B P41595 1/20 0.54
SIGMAR1 Q99720 4/20 0.49
TMEM97 Q5BJF2 1/20 0.49
CACNA1F O60840 2/20 0.48
ADORA3 P0DMS8 2/20 0.48
DRD4 P21917 2/20 0.48
HRH2 P25021 2/20 0.48
ADRA1D P25100 2/20 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
Hydrochloric Acid SCHEMBL7327779 0.92 MEN1 (0.54) DRD2DRD3HTR1AHTR2ADRD5
Hydrochloric Acid SCHEMBL7326824 0.87 DRD3 (0.52) DRD2DRD3HTR1AHTR2ADRD5
Hydrochloric Acid SCHEMBL7319716 0.85 SLC6A3 (0.47) DRD2DRD3HTR1AHTR2ADRD5
SCHEMBL9143010 0.84 MAPT (0.56) DRD2DRD3HTR1AHTR2ADRD5
SCHEMBL5026310 0.84 KCNH2 (0.53) DRD2DRD3HTR1AHTR2ADRD5
Hydrochloric Acid SCHEMBL7318462 0.82 KCNH2 (0.49) DRD2DRD3HTR1AHTR2ADRD5
SCHEMBL10334811 0.77 SCN5A (0.58) DRD2DRD3HTR1AHTR2ADRD5
SCHEMBL9140855 0.77 MAPT (0.62) DRD2DRD3HTR1AHTR2ADRD5
Hydrochloric Acid SCHEMBL11811594 0.75 DRD2 (0.70) DRD2DRD3HTR1AHTR2ADRD5
SCHEMBL904905 0.75 DRD2 (0.83) DRD2DRD3HTR1AHTR2ADRD5

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
US-4933346-A CARDIOVASCULAR AND CEREBROVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1990-06-12 US disclosed
EP-0290958-A2 Diarylalkyl-substituted alkylamines, process for their preparation, their use as well as medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-17 EP disclosed