SCHEMBL8071818

SCHEMBL8071818

Cc1c(C(=O)c2cccc3ccccc23)c2ccccc2n1CC1CCCCN1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 7/20 0.68
CNR2 P34972 7/20 0.68
MEN1 O00255 1/20 0.62
NR1I2 O75469 1/20 0.62
ALDH1A1 P00352 1/20 0.62
CYP1A2 P05177 1/20 0.62
MAPT P10636 1/20 0.62
HPGD P15428 1/20 0.62
TSHR P16473 1/20 0.62
MAPK1 P28482 1/20 0.62
CYP2C19 P33261 1/20 0.62
KMT2A Q03164 1/20 0.62
NR1H4 Q96RI1 1/20 0.62
SLC6A3 Q01959 1/20 0.59

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
SCHEMBL29361510 0.86 CNR2 (0.53) CNR1CNR2
SCHEMBL15668673 0.86 CNR2 (0.53) CNR1CNR2
SCHEMBL19638890 0.82 ADRA2A (0.48)
SCHEMBL9037761 0.81 CNR1 (0.82) CNR1CNR2MEN1NR1I2ALDH1A1
SCHEMBL9302345 0.80 CNR1 (0.61) CNR1
SCHEMBL9691161 0.80 CNR2 (0.67) CNR1CNR2MEN1NR1I2ALDH1A1
SCHEMBL9302415 0.80 CNR1 (0.70) CNR1CNR2
SCHEMBL29361364 0.80 CNR1 (0.70) CNR1CNR2
Hydrochloric Acid SCHEMBL8533745 0.79 ADRA2A (0.46) CNR1
SCHEMBL497044 0.77 CNR2 (1.00) CNR1CNR2MEN1NR1I2ALDH1A1

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
US-6013648-A IMMUNOMODULATORS SANOFI (FR) 2000-01-11 US disclosed
WO-1997000860-A1 CB2 RECEPTOR AGONIST COMPOUNDS SANOFI (FR) 1997-01-09 WO disclosed