SCHEMBL3785508

SCHEMBL3785508

CN1CCc2c(c3cc(F)ccc3n2C=Cc2cccc(F)c2)C1

nearest known ligand 0.85

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 18/20 0.85
HRH1 P35367 8/20 0.66
ADRA2A P08913 1/20 0.66
DRD2 P14416 1/20 0.66
HTR2A P28223 1/20 0.66
HTR2C P28335 1/20 0.66
HTR7 P34969 1/20 0.66
ADRA1A P35348 1/20 0.66

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
SCHEMBL3785505 1.00 HTR6 (0.85) HTR6HRH1ADRA2ADRD2HTR2A
SCHEMBL3785503 1.00 HTR6 (0.85) HTR6HRH1ADRA2ADRD2HTR2A
SCHEMBL2186455 0.92 HTR6 (1.00) HTR6HRH1ADRA2ADRD2HTR2A
SCHEMBL3026846 0.92 HTR6 (1.00) HTR6HRH1ADRA2ADRD2HTR2A
SCHEMBL2186459 0.92 HTR6 (1.00) HTR6HRH1ADRA2ADRD2HTR2A
SCHEMBL3034893 0.90 HTR6 (1.00) HTR6HRH1ADRA2ADRD2HTR2A
SCHEMBL3034894 0.90 HTR6 (1.00) HTR6HRH1ADRA2ADRD2HTR2A
SCHEMBL2191362 0.87 HTR6 (1.00) HTR6HRH1ADRA2ADRD2HTR2A
SCHEMBL2191361 0.87 HTR6 (1.00) HTR6HRH1ADRA2ADRD2HTR2A
SCHEMBL3039535 0.86 HTR6 (0.77) HTR6HRH1ADRA2ADRD2HTR2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2145887-B1 SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-PYRIDO[4,3-B]INDOLES, METHODS FOR THE PRODUCTION AND USE THEREOF ALLA CHEM LLC (US) 2016-04-27 EP claimed
EP-2145887-A2 SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-PYRIDO[4,3-B]INDOLES, METHODS FOR THE PRODUCTION AND USE THEREOF Alla Chem, LLC. (US) 2010-01-20 EP claimed
EP-2145887-A2 SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-PYRIDO[4,3-B]INDOLES, METHODS FOR THE PRODUCTION AND USE THEREOF Alla Chem, LLC. (US) 2010-01-20 EP disclosed