SCHEMBL8089367

SCHEMBL8089367

CCCCCOc1c(OC)ccc2c1CC(=O)N(CCc1ccncc1)C2=O

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 13/20 0.57
LMNA P02545 1/20 0.41
GRM5 P41594 1/20 0.37
THRB P10828 1/20 0.37
APAF1 O14727 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
CASP1 P29466 1/20 0.35
RAB9A P51151 1/20 0.35
BLM P54132 1/20 0.35
CASP7 P55210 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TP53 P04637 1/20 0.34
MDM2 Q00987 1/20 0.34
POLB P06746 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
SCHEMBL4544214 0.84 CNR2 (0.79) CNR2LMNATHRBTP53MDM2
SCHEMBL4417012 0.83 CNR2 (0.79) CNR2THRBPOLB
SCHEMBL4408549 0.73 CNR2 (0.83) CNR2ALDH1A1GAAMAPTRAB9A
SCHEMBL4409929 0.73 CNR2 (1.00) CNR2
SCHEMBL4411949 0.73 CNR2 (0.82) CNR2GRM5TP53MDM2
SCHEMBL4405983 0.73 CNR2 (1.00) CNR2
SCHEMBL8091179 0.72 CNR2 (1.00) CNR2LMNAALDH1A1GAAMAPT
SCHEMBL4409562 0.72 CNR2 (0.84) CNR2LMNAALDH1A1GAAMAPT
SCHEMBL4411477 0.71 CNR2 (1.00) CNR2LMNAALDH1A1POLB
SCHEMBL4418089 0.71 CNR2 (0.82) CNR2ALDH1A1GAAMAPTKMT2A

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-6017919-A Compounds and pharmaceutical use thereof JAPAN TOBACCO INC. (JP) 2000-01-25 US disclosed
EP-0887340-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL USE THEREOF Japan Tobacco Inc. (JP) 1998-12-30 EP disclosed