SCHEMBL5267965

SCHEMBL5267965

[CH2]CCCc1cc(OCCCC)cc(OCCCC)c1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 16/20 0.46
CNR2 P34972 14/20 0.46
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
FUT7 Q11130 1/20 0.41
PLA2G2A P14555 1/20 0.41
PTGS2 P35354 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
SCHEMBL5269400 0.95 CNR1 (0.49) CNR1CNR2CA1CA2CA9
SCHEMBL5347076 0.93 CNR1 (0.51) CNR1CNR2FUT7PLA2G2A
SCHEMBL5273404 0.93 CNR1 (0.51) CNR1CNR2FUT7PLA2G2A
SCHEMBL5270281 0.93 CNR1 (0.51) CNR1CNR2FUT7PLA2G2A
SCHEMBL5265104 0.93 CNR1 (0.51) CNR1CNR2FUT7PLA2G2A
SCHEMBL5269132 0.93 CNR1 (0.51) CNR1CNR2FUT7PLA2G2A
SCHEMBL5268147 0.93 CNR1 (0.51) CNR1CNR2FUT7PLA2G2A
SCHEMBL5271406 0.93 CNR1 (0.51) CNR1CNR2FUT7PLA2G2A
SCHEMBL5266362 0.93 CNR1 (0.51) CNR1CNR2FUT7PLA2G2A
SCHEMBL5272601 0.93 CNR1 (0.51) CNR1CNR2FUT7PLA2G2A

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
EP-1843407-A1 Liquid crystalline rylenetetracarboxylic acid derivatives and their use BASF AKTIENGESELLSCHAFT (DE) 2007-10-10 EP disclosed