SCHEMBL11684164

SCHEMBL11684164

CC=CC=CC(=O)OOC(C)(C)CCC(C)(C)OOC(=O)C=CC=CC

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.34
CNR2 P34972 4/20 0.34
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
TRPA1 O75762 1/20 0.31
TRPV1 Q8NER1 1/20 0.31

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
SCHEMBL11766013 1.00 CNR1 (0.34) CNR1CNR2LMNAMAPK1HTT
SCHEMBL11865599 0.82 CNR1 (0.33) CNR1CNR2LMNAMAPK1HTT
SCHEMBL11683796 0.82 CNR1 (0.31) CNR1CNR2LMNAMAPK1HTT
SCHEMBL21387038 0.81 CNR1 (0.36) CNR1CNR2LMNAMAPK1HTT
SCHEMBL2553693 0.77 MAPK1 (0.38) CNR1CNR2LMNAMAPK1HTT
SCHEMBL8740231 0.77 TSHR (0.32)
SCHEMBL8740228 0.77 TSHR (0.32)
SCHEMBL11686949 0.76 CNR1 (0.31) CNR1CNR2LMNAMAPK1HTT
SCHEMBL11683775 0.76 CNR1 (0.32) CNR1CNR2LMNAMAPK1HTT
SCHEMBL11683780 0.76 CNR1 (0.32) CNR1CNR2LMNAMAPK1HTT

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-4045463-A POLYMERIZABLE MONOMERS OR FREE RADICAL INITIATORS NIPPON OIL AND FATS CO., LTD. (JA) 1977-08-30 US claimed
US-4045463-A POLYMERIZABLE MONOMERS OR FREE RADICAL INITIATORS NIPPON OIL AND FATS CO., LTD. (JA) 1977-08-30 US disclosed