SCHEMBL27675855

SCHEMBL27675855

C=CCc1ccc(O)cc1OCCCCC.CCC(=O)CC

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.51
CNR1 P21554 9/20 0.51
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYSLTR2 Q9NS75 1/20 0.41
CYSLTR1 Q9Y271 1/20 0.41

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
SCHEMBL27675857 0.97 CNR2 (0.48) CNR2CNR1KDM4EMAPK1L3MBTL1
SCHEMBL27694416 0.90 CNR2 (0.41) CNR2CNR1KDM4EMAPK1L3MBTL1
SCHEMBL27694385 0.86 CNR2 (0.41) CNR2CNR1KDM4EMAPK1L3MBTL1
SCHEMBL27694418 0.85 CNR2 (0.43) CNR2CNR1KDM4EMAPK1L3MBTL1
SCHEMBL27675866 0.82 PTPN1 (0.45) KDM4EL3MBTL1
SCHEMBL27675865 0.81 CNR2 (0.40) CNR2CNR1KDM4EMAPK1L3MBTL1
SCHEMBL27694388 0.81 CNR2 (0.40) CNR2CNR1KDM4EMAPK1L3MBTL1
SCHEMBL3260822 0.77 PPARA (0.53) CNR2CNR1KDM4E
SCHEMBL9698367 0.75 CNR2 (0.62) CNR2CNR1
SCHEMBL2839058 0.75 CNR2 (0.52) CNR2CNR1KDM4EMAPK1L3MBTL1

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
CN-88100650-A Anti-inflammatory agent 1988-10-19 CN disclosed