SCHEMBL9905800

SCHEMBL9905800

C=CC(=O)N(c1ccccc1)C1CN2CCC1CC2

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 18/20 0.59
▸ CHRM3 P20309 18/20 0.59
▸ CHRM5 P08912 17/20 0.59
▸ CHRM2 P08172 7/20 0.59

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
SCHEMBL28540751 0.74 CHRM1 (0.74) CHRM1CHRM3CHRM5CHRM2
SCHEMBL28909842 0.73 CHRM1 (0.71) CHRM1CHRM3CHRM5CHRM2
SCHEMBL11579712 0.72 TRPM8 (0.44) CHRM3CHRM2
SCHEMBL11500743 0.71 TRPM8 (0.46) —
SCHEMBL16292695 0.71 CHRM1 (0.54) CHRM1CHRM3CHRM5CHRM2
SCHEMBL18763039 0.71 TRPM8 (0.67) CHRM3CHRM2
SCHEMBL9672698 0.70 CHRM1 (0.51) CHRM1CHRM3CHRM5CHRM2
SCHEMBL16292719 0.70 CHRM1 (0.50) CHRM1CHRM3CHRM5CHRM2
SCHEMBL4960958 0.69 CHRM1 (0.49) CHRM1CHRM3CHRM5CHRM2
SCHEMBL11442250 0.69 TRPM8 (0.35) —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2384768-B1 Phenylpropionamide compounds and the use thereof PURDUE PHARMA LP (US) 2013-08-21 — — EP disclosed
EP-2079485-B1 PHENYLPROPIONAMIDE COMPOUNDS AND THE USE THEREOF PURDUE PHARMA LP (US) 2012-06-13 — — EP disclosed
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