SCHEMBL1730141

SCHEMBL1730141

CNC(=O)CN(CCC1CCN(c2cc3cc(OC)ccc3cn2)CC1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 1/20 0.40
ACHE P22303 4/20 0.38
ABL1 P00519 1/20 0.38
HRH3 Q9Y5N1 5/20 0.37
MCHR1 Q99705 3/20 0.37
ENPP1 P22413 1/20 0.37
HSD17B10 Q99714 1/20 0.36
CKS1B P61024 2/20 0.35
SKP1 P63208 2/20 0.35
SKP2 Q13309 2/20 0.35
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
MAP4K4 O95819 1/20 0.35

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
SCHEMBL1729260 0.89 HTR3A (0.42) CHRM4CKS1BSKP1SKP2MAP4K4
SCHEMBL1728923 0.88 HRH3 (0.49) CHRM4ACHEHRH3MCHR1ENPP1
SCHEMBL1729777 0.88 SMO (0.40) CKS1BSKP1SKP2MAP4K4
SCHEMBL1729234 0.83 ENPP1 (0.42) ACHEENPP1
SCHEMBL1728885 0.80 CHRM4 (0.53) CHRM4ACHEABL1ENPP1
SCHEMBL3270570 0.79 CHRM4 (0.46) CHRM4ACHEABL1ENPP1
SCHEMBL1727774 0.79 HRH3 (0.48) CHRM4ACHEHRH3MCHR1
SCHEMBL1728139 0.79 CHRM4 (0.39) CHRM4ABL1MAP4K4
SCHEMBL1729776 0.79 HRH3 (0.47) CHRM4ACHEHRH3HSD17B10CKS1B
SCHEMBL1730249 0.77 HTR3A (0.42) CHRM4CKS1BSKP1SKP2

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-1633735-B1 DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES, PREPARATION METHODS THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI SA (FR) 2011-11-30 EP claimed