SCHEMBL29019184

SCHEMBL29019184

C=CCCCn1cc(C(=O)NC(C(N)=O)C(C)C)c2ccccc21

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 19/20 0.81
▸ CNR1 P21554 18/20 0.81

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
SCHEMBL17613433 0.86 CNR2 (0.94) CNR2CNR1
SCHEMBL30353011 0.86 CNR2 (0.94) CNR2CNR1
SCHEMBL17613438 0.85 CNR2 (0.80) CNR2CNR1
SCHEMBL17613436 0.85 CNR2 (0.80) CNR2CNR1
SCHEMBL28620452 0.84 CNR2 (0.80) CNR2CNR1
SCHEMBL17613437 0.84 CNR2 (0.79) CNR2CNR1
SCHEMBL30554867 0.84 CNR2 (0.80) CNR2CNR1
SCHEMBL17613440 0.82 CNR2 (0.74) CNR2CNR1
SCHEMBL28725459 0.78 NR4A2 (0.65) CNR2CNR1
SCHEMBL28725466 0.78 SMN1; SMN2 (0.63) CNR2CNR1

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
CN-116297923-A Rapid identification method for indole and indazole type synthetic cannabinoid novel psychoactive substance structure 广西大学 2023-06-23 — — CN disclosed
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