SCHEMBL7806971

SCHEMBL7806971

c1ccc(N2CCN(CCCn3ccc4ccc(-n5cnnc5)cc43)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 6/20 0.60
DRD2 P14416 4/20 0.60
DRD4 P21917 3/20 0.60
HTR1D P28221 1/20 0.53
HTR1B P28222 1/20 0.53
HTR1A P08908 2/20 0.47
HTR7 P34969 2/20 0.47
SIGMAR1 Q99720 3/20 0.47
KCNH2 Q12809 1/20 0.47
P2RX7 Q99572 3/20 0.46
CYP2D6 P10635 1/20 0.44

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 SCHEMBL8031131 0.99 DRD3 (0.59) DRD3DRD2DRD4HTR1DHTR1B
SCHEMBL7804093 0.88 HTR1D (0.54) DRD3DRD2DRD4HTR1DHTR1B
Hydrochloric Acid SCHEMBL8021793 0.87 HTR1D (0.53) DRD3DRD2DRD4HTR1DHTR1B
SCHEMBL7804144 0.86 KCNH2 (0.50) DRD3DRD2DRD4HTR1DHTR1B
SCHEMBL7805927 0.86 HTR7 (0.50) DRD3DRD2DRD4HTR1DHTR1B
SCHEMBL7808859 0.86 DRD2 (0.51) DRD3DRD2HTR1AHTR7SIGMAR1
Hydrochloric Acid SCHEMBL8031163 0.86 KCNH2 (0.49) DRD3DRD2DRD4HTR1DHTR1B
Hydrochloric Acid SCHEMBL8035305 0.85 DRD2 (0.50) DRD3DRD2HTR1AHTR7SIGMAR1
Hydrochloric Acid SCHEMBL8021825 0.85 HTR7 (0.49) DRD3DRD2DRD4HTR1DHTR1B
SCHEMBL7805912 0.83 HTR1D (0.51) DRD3DRD2DRD4HTR1DHTR1B

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