SCHEMBL8816423

SCHEMBL8816423

C=Cc1ccc(OCCCCCCCCCCC(=O)OCC(CO)OCCCCCCCCCCCCCCCCCC)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 6/20 0.52
▸ CNR1 P21554 1/20 0.51
▸ PRKCA P17252 4/20 0.50
▸ PRKCE Q02156 2/20 0.50
▸ PRKCQ Q04759 2/20 0.50
▸ PRKCD Q05655 2/20 0.50
▸ KDM4E B2RXH2 1/20 0.46
▸ DUSP3 P51452 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ PLA2G4B P0C869 1/20 0.46

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
SCHEMBL9276799 0.91 CNR2 (0.46) CNR2CNR1PRKCAPRKCEPRKCQ
SCHEMBL13933053 0.85 DGKA (0.53) CNR2PLA2G4B
SCHEMBL13933052 0.85 DGKA (0.53) CNR2PLA2G4B
SCHEMBL16782005 0.82 PRKCA (0.72) CNR2CNR1PRKCAPRKCEPRKCQ
SCHEMBL13541840 0.82 PRKCA (0.72) CNR2CNR1PRKCAPRKCEPRKCQ
SCHEMBL3758588 0.82 PRKCA (0.72) CNR2CNR1PRKCAPRKCEPRKCQ
SCHEMBL21419885 0.82 PRKCA (0.72) CNR2CNR1PRKCAPRKCEPRKCQ
SCHEMBL12978613 0.82 PRKCA (0.72) CNR2CNR1PRKCAPRKCEPRKCQ
SCHEMBL27604159 0.82 PRKCA (0.72) CNR2CNR1PRKCAPRKCEPRKCQ
SCHEMBL8679377 0.82 PRKCA (0.72) CNR2CNR1PRKCAPRKCEPRKCQ

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-5693477-A CONTAINING ION CHANNELS CAPABLE OF FORMING HELICES AND AGGREGATES AUSTRALIAN MEMBRANE AND BIOTECHNOLOGY RESEARCH INSTITUTE (AU) 1997-12-02 — — US disclosed
US-5436170-A Crosslinking COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1995-07-25 — — US disclosed
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