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Sugi Predict / Compounds / SCHEMBL1029328

SCHEMBL1029328

SCHEMBL1029328

COc1ccc(/C=C2\CN(C(C)=O)Cc3c(OC(=O)N[C@H](C)c4ccccn4)nn(-c4ccc(Cl)cc4Cl)c32)cc1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 20/20 0.69
▸ CNR2 P34972 15/20 0.69

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
SCHEMBL1028730 1.00 CNR1 (0.69) CNR1CNR2
SCHEMBL1030012 0.93 CNR1 (0.67) CNR1CNR2
SCHEMBL1029373 0.91 CNR1 (0.68) CNR1CNR2
SCHEMBL1028384 0.90 CNR1 (0.63) CNR1CNR2
SCHEMBL1029667 0.89 CNR1 (0.85) CNR1CNR2
SCHEMBL1027270 0.89 CNR1 (0.85) CNR1CNR2
SCHEMBL300515 0.89 CNR1 (0.71) CNR1CNR2
SCHEMBL300380 0.89 CNR1 (0.71) CNR1CNR2
SCHEMBL1030261 0.88 CNR1 (0.62) CNR1CNR2
SCHEMBL1027457 0.88 CNR1 (0.62) CNR1CNR2

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-1804791-B1 TETRAHYDRO PYRIDINYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2011-01-19 — — EP claimed