SCHEMBL8077971

SCHEMBL8077971

CCCCCOc1cc2c(cc1OC)CCN(CCc1ccc(O)cc1)C2=O

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.68
GPR84 Q9NQS5 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HTR2A P28223 3/20 0.44
HTR2C P28335 3/20 0.44
HTR2B P41595 3/20 0.44
HTR1A P08908 2/20 0.44
HTR7 P34969 2/20 0.44

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
SCHEMBL8085018 0.88 CNR2 (0.54) CNR2GPR84MEN1KMT2AHTR2A
SCHEMBL4409616 0.81 CNR2 (1.00) CNR2MEN1KMT2A
SCHEMBL4405919 0.75 CNR2 (0.80) CNR2MEN1KMT2AHTR2C
SCHEMBL4405983 0.74 CNR2 (1.00) CNR2
SCHEMBL9666604 0.73 MEN1 (0.61) MEN1KMT2AHTR1A
SCHEMBL8091141 0.73 CNR2 (0.62) CNR2MEN1KMT2A
SCHEMBL8089406 0.73 CNR2 (0.70) CNR2MEN1KMT2AHTR2C
SCHEMBL4551332 0.72 CNR2 (0.89) CNR2HTR2C
SCHEMBL4409562 0.72 CNR2 (0.84) CNR2MEN1KMT2A
SCHEMBL4418089 0.71 CNR2 (0.82) CNR2MEN1KMT2A

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