SCHEMBL11565787

SCHEMBL11565787

N#CCC(Cl)Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 2/20 0.49
IDO1 P14902 4/20 0.42
MAOB P27338 1/20 0.41
TAAR1 Q96RJ0 1/20 0.40
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
SIGMAR1 Q99720 3/20 0.36
PYCR1 P32322 1/20 0.36
DPP4 P27487 1/20 0.35
FAP Q12884 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
IGF1R P08069 1/20 0.35
ALOX15 P16050 1/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34

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
SCHEMBL8499284 0.78 PNMT (0.52) PNMTIDO1TAAR1SLC6A2SLC6A4
SCHEMBL11565773 0.77 PNMT (0.51) PNMTIDO1TAAR1
SCHEMBL4419129 0.76 PNMT (0.53) PNMTIDO1TAAR1SLC6A2SLC6A4
SCHEMBL26649158 0.73 PNMT (0.59) PNMTIDO1MAOBTAAR1SLC6A2
SCHEMBL29609180 0.72 IDO1 (0.52) PNMTIDO1TAAR1SLC6A2SLC6A4
SCHEMBL2308 0.72 IDO1 (0.52) PNMTIDO1TAAR1SLC6A2SLC6A4
SCHEMBL8893657 0.71 PNMT (0.68) PNMTIDO1TAAR1SLC6A2SLC6A4
SCHEMBL14846267 0.70 IGF1R (0.53) PNMTIDO1TAAR1SIGMAR1IGF1R
SCHEMBL14829408 0.69 IGF1R (0.56) PNMTIDO1TAAR1SIGMAR1IGF1R
SCHEMBL26004833 0.69 PNMT (0.64) PNMTIDO1TAAR1SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4145362-A DIAZOTIZATION OF ARYLAMINE IN PRESENCE OF ALKANOIC ACID, COPPER HALIDE CATALYST S.A. P R B EN NEERLANDAIS PRB N.V. (BE) 1979-03-20 US disclosed