SCHEMBL7804169

SCHEMBL7804169

c1ccc(CN2CCC(n3ccc4ccc(-n5cnnc5)cc43)CC2)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 3/20 0.46
HTR1B P28222 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.42
DRD4 P21917 2/20 0.42
DRD2 P14416 1/20 0.41
SLC6A4 P31645 1/20 0.41
PRKCG P05129 2/20 0.41
PRKCB P05771 2/20 0.41
PRKCA P17252 2/20 0.41
PRKCE Q02156 2/20 0.41
PIP5K1C O60331 1/20 0.41
RPS6KA5 O75582 1/20 0.41
RPS6KA4 O75676 1/20 0.41
STK16 O75716 1/20 0.41
PAK3 O75914 1/20 0.41
CDK14 O94921 1/20 0.41
MET P08581 1/20 0.41
PDGFRB P09619 1/20 0.41
KIT P10721 1/20 0.41
PIM1 P11309 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
Hydrochloric Acid SCHEMBL8021805 0.99 HTR1D (0.45) HTR1DHTR1BL3MBTL1DRD4DRD2
SCHEMBL7804880 0.92 HTR1D (0.46) HTR1DHTR1BL3MBTL1DRD4DRD2
Hydrochloric Acid SCHEMBL8037826 0.91 HTR1D (0.45) HTR1DHTR1BL3MBTL1DRD4DRD2
SCHEMBL7804156 0.85 DRD2 (0.48) HTR1DHTR1BDRD4DRD2SLC6A4
Hydrochloric Acid SCHEMBL8033624 0.84 DRD2 (0.47) HTR1DHTR1BDRD4DRD2SLC6A4
SCHEMBL4758506 0.82 DRD2 (0.59) L3MBTL1DRD4DRD2SLC6A4PRKCG
SCHEMBL7804121 0.81 HTR1D (0.44) HTR1DHTR1BL3MBTL1DRD4KDM4E
Hydrochloric Acid SCHEMBL8031546 0.81 HTR1D (0.44) HTR1DHTR1BL3MBTL1DRD4KDM4E
Hydrochloric Acid SCHEMBL8172775 0.79 HTR1D (0.45) HTR1DHTR1BDRD2SLC6A4JAK3
SCHEMBL7798125 0.79 HTR1D (0.56) HTR1DHTR1BDRD4DRD2KDM4E

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