SCHEMBL8085206

SCHEMBL8085206

CN(C)c1ccc2c(c1)C(c1ccc(Cl)c(Cl)c1)CC2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 12/20 0.44
SLC6A4 P31645 12/20 0.44
SLC6A3 Q01959 12/20 0.44
CYP2D6 P10635 5/20 0.43
CYP2C9 P11712 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.43
MLNR O43193 1/20 0.43
NR1I2 O75469 1/20 0.43
ABCB11 O95342 1/20 0.43
ESR1 P03372 1/20 0.43
CYP1A2 P05177 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
ABCB1 P08183 1/20 0.43
ADRB1 P08588 1/20 0.43
CYP3A4 P08684 1/20 0.43
HTR1A P08908 1/20 0.43
CHRM5 P08912 1/20 0.43

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
SCHEMBL6946126 0.76 SLC6A4 (0.70) SLC6A2SLC6A4SLC6A3CYP2D6MEN1
SCHEMBL5709376 0.76 SLC6A2 (0.60) SLC6A2SLC6A4SLC6A3CYP2D6CYP2C9
SCHEMBL14596264 0.71 HTR2A (0.37) SLC6A2SLC6A4ADRB1HTR1AADRA2A
SCHEMBL28129775 0.70 SIGMAR1 (0.55) HTR2AHTR2CADRA1AHTR2BSIGMAR1
SCHEMBL8938880 0.70 IGF1R (0.54) CYP2C9CYP3A4DRD2ADRA2CMTOR
SCHEMBL5450678 0.69 ACHE (0.51) HTR1AHTR2A
SCHEMBL2056277 0.69 ALDH1A1 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6KMT2A
SCHEMBL29757864 0.68 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3CYP2D6MEN1
SCHEMBL5029704 0.68 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3CYP2D6MEN1
SCHEMBL8238524 0.68 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3CYP2D6MEN1

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-1044184-A1 SYNTHESIS OF 3-ARYL-1-INDANAMINES Pharm-Eco Laboratoires, Incorporated (US) 2000-10-18 EP disclosed
WO-1999035119-A1 SYNTHESIS OF 3-ARYL-1-INDANAMINES PHARM-ECO LABORATORIES, INC. (US) 1999-07-15 WO disclosed