SCHEMBL11602876

SCHEMBL11602876

CCCCCCC(C)(C)c1c(Cc2ccccc2)c(O)c(C2=C(CBr)CCC(C)C2)c(O)c1Cc1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 13/20 0.34
▸ CNR1 P21554 7/20 0.34
▸ GPR18 Q14330 1/20 0.34
▸ GPR55 Q9Y2T6 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.33
▸ HTT P42858 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HPGD P15428 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 1/20 0.32

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
SCHEMBL11604632 0.92 CNR2 (0.34) CNR2CNR1GPR18GPR55KDM4E
SCHEMBL11601899 0.89 CNR1 (0.35) CNR2CNR1GPR18GPR55KDM4E
SCHEMBL11603342 0.89 CNR1 (0.33) CNR2CNR1GPR18GPR55KDM4E
SCHEMBL11599818 0.85 CNR1 (0.37) CNR2CNR1KDM4EHTTSMN1; SMN2
SCHEMBL11601473 0.83 CNR1 (0.33) CNR2CNR1GPR18GPR55KDM4E
SCHEMBL11604199 0.82 CNR1 (0.34) CNR2CNR1GPR18GPR55KDM4E
SCHEMBL11602984 0.82 CNR1 (0.34) CNR2CNR1GPR18GPR55KDM4E
SCHEMBL11601020 0.82 CNR1 (0.32) CNR2CNR1GPR18GPR55KDM4E
SCHEMBL11603869 0.78 CNR1 (0.32) CNR2CNR1GPR18GPR55KDM4E
SCHEMBL11601819 0.77 CNR1 (0.37) CNR2CNR1KDM4EHTTSMN1; SMN2

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
US-4092344-A Cyclohexenyl resorcinol derivatives ELI LILLY AND COMPANY (US) 1978-05-30 — — US disclosed
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