SCHEMBL29019193

SCHEMBL29019193

CCCCCn1cc(C(=O)Cc2cccc3ccccc23)c2ccccc21

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 20/20 0.77
▸ CNR1 P21554 3/20 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
SCHEMBL29387464 0.87 CNR2 (1.00) CNR2CNR1
SCHEMBL29410255 0.87 CNR2 (1.00) CNR2CNR1
SCHEMBL2473611 0.87 CNR2 (1.00) CNR2CNR1
SCHEMBL15478802 0.87 CNR2 (0.79) CNR2CNR1
SCHEMBL29989465 0.86 CNR2 (1.00) CNR2CNR1
SCHEMBL29858202 0.86 CNR2 (1.00) CNR2CNR1
SCHEMBL16201543 0.86 CNR2 (1.00) CNR2CNR1
SCHEMBL29358962 0.86 CNR2 (1.00) CNR2CNR1
SCHEMBL11983322 0.84 CNR2 (1.00) CNR2CNR1
SCHEMBL29359634 0.84 CNR2 (1.00) 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
Send feedback