SCHEMBL8958232

SCHEMBL8958232

CCc1ccccc1C(N)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42
OPRL1 P41146 1/20 0.42
MPO P05164 1/20 0.42
TPO P07202 1/20 0.42
HTT P42858 1/20 0.41
DPP4 P27487 2/20 0.39
F2 P00734 1/20 0.39
TAAR1 Q96RJ0 3/20 0.38
LMNA P02545 1/20 0.38
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
HTR2A P28223 1/20 0.37
ADRA2A P08913 1/20 0.36
ADRA2C P18825 1/20 0.36

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
SCHEMBL14840583 0.87 GABRA1 (0.41) OPRM1OPRD1OPRK1OPRL1SLC6A2
SCHEMBL9719141 0.82 DPP4 (0.55) DPP4F2TAAR1LMNAHTR2A
SCHEMBL8558251 0.82 TAAR1 (0.43) MPOTPODPP4F2TAAR1
Hydrochloric Acid SCHEMBL8865240 0.80 TAAR1 (0.41) MPOTPODPP4F2TAAR1
SCHEMBL8555524 0.79 HTR2A (0.40) MPOTPODPP4F2TAAR1
SCHEMBL17871883 0.79 SLC6A4 (0.48) SLC6A2SLC6A4HTR2A
SCHEMBL6546270 0.79 HTR2A (0.45) OPRM1OPRD1OPRK1OPRL1HTT
SCHEMBL5012621 0.79 GABRA1 (0.41) OPRM1OPRD1OPRK1OPRL1HTT
Hydrochloric Acid SCHEMBL8596089 0.78 CYP3A4 (0.42) MPOTPOTAAR1SLC6A2SLC6A4
SCHEMBL3074943 0.78 HTT (0.45) OPRM1OPRD1OPRK1OPRL1HTT

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-5536877-A Preparation of arylbenzylamines BASF AKTIENGESELLSCHAFT (DE) 1996-07-16 US disclosed