SCHEMBL7804083

SCHEMBL7804083

FC(F)(F)c1cccc(N2CCN(CCCn3ncc4ccc(-n5cnnc5)cc43)CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.49
SLC6A3 Q01959 1/20 0.49
SIGMAR1 Q99720 2/20 0.49
HTR2A P28223 4/20 0.49
SLC6A4 P31645 2/20 0.49
DRD2 P14416 4/20 0.48
DRD3 P35462 4/20 0.48
ADRA1A P35348 2/20 0.48
HTR7 P34969 5/20 0.47
HTR1A P08908 2/20 0.47
HTR6 P50406 2/20 0.47
DRD5 P21918 1/20 0.46
HTR2C P28335 1/20 0.45
DRD1 P21728 1/20 0.45

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 SCHEMBL8037884 0.99 SLC6A2 (0.49) SLC6A2SLC6A3SIGMAR1HTR2ASLC6A4
SCHEMBL15748030 0.85 HTR2A (0.59) SLC6A2SLC6A3SIGMAR1HTR2ASLC6A4
SCHEMBL7808859 0.84 DRD2 (0.51) SLC6A2SLC6A3SIGMAR1HTR2ASLC6A4
Hydrochloric Acid SCHEMBL8035305 0.83 DRD2 (0.50) SIGMAR1HTR2ASLC6A4DRD2DRD3
SCHEMBL7804944 0.80 DRD2 (0.51) SLC6A2SLC6A3SIGMAR1HTR2ASLC6A4
SCHEMBL7798311 0.80 HTR1D (0.48) HTR2ADRD3HTR2C
Hydrochloric Acid SCHEMBL8021813 0.80 DRD2 (0.50) SIGMAR1HTR2ASLC6A4DRD2DRD3
Hydrochloric Acid SCHEMBL8021858 0.79 HTR1D (0.47) HTR2ADRD3HTR2C
SCHEMBL7804951 0.77 HTR1D (0.53) SLC6A2SLC6A3SIGMAR1HTR2ASLC6A4
SCHEMBL11465528 0.77 SIGMAR1 (0.76) SIGMAR1HTR2ADRD2DRD3ADRA1A

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-0902027-B1 Indole and indazole derivatives, process for their preparation and the pharmaceutical compositions containing them ADIR (FR) 2001-07-25 EP disclosed
EP-0902027-A1 Indole and indazole derivatives, process for their preparation and the pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-03-17 EP disclosed