SCHEMBL8091179

SCHEMBL8091179

CCCCCOc1c(OC)ccc2c1C(=O)N(CCc1ccc(O)cc1)C2=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 1.00
LMNA P02545 1/20 0.40
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL8078040 0.82 CNR2 (0.69) CNR2LMNAALDH1A1
SCHEMBL4405983 0.80 CNR2 (1.00) CNR2
SCHEMBL4409616 0.78 CNR2 (1.00) CNR2GAAALDH1A1MAPTHTT
SCHEMBL8085081 0.77 CNR2 (0.62) CNR2GAAALDH1A1MAPTHTT
SCHEMBL8085623 0.77 CNR2 (0.71) CNR2HTT
SCHEMBL4368102 0.75 CNR2 (0.59) CNR2LMNAGAAALDH1A1MAPT
SCHEMBL4408457 0.74 CNR2 (1.00) CNR2LMNA
SCHEMBL8089408 0.73 CNR2 (0.65) CNR2
SCHEMBL4551332 0.73 CNR2 (0.89) CNR2LMNAALDH1A1
SCHEMBL4411502 0.72 CNR2 (0.63) CNR2MAPT

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