SCHEMBL1728880

SCHEMBL1728880

CC(C)Cc1ccc(N2CCC(CCNC(=O)O)CC2)nc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 14/20 0.49
ENPP2 Q13822 1/20 0.47
CHRM2 P08172 3/20 0.46
CHRM1 P11229 3/20 0.46
CHRM5 P08912 2/20 0.45
CHRM3 P20309 1/20 0.45
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PANK3 Q9H999 1/20 0.43

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
SCHEMBL15662802 0.86 CHRM4 (0.50) CHRM4CHRM2CHRM1CHRM5CHRM3
SCHEMBL1728839 0.84 CHRM4 (0.52) CHRM4CHRM2CHRM1CHRM5CHRM3
SCHEMBL1728730 0.81 MAOA (0.55) CHRM4CHRM2CHRM1CHRM5CHRM3
SCHEMBL345057 0.81 CHRM4 (0.57) CHRM4CHRM2CHRM1CHRM5CHRM3
SCHEMBL345439 0.80 ENPP2 (0.45) CHRM4ENPP2LMNAMAPTSMN1; SMN2
SCHEMBL345491 0.80 ENPP2 (0.43) CHRM4ENPP2PANK3
SCHEMBL2334744 0.79 CHRM4 (0.48) CHRM4CHRM2CHRM1CHRM5CHRM3
SCHEMBL1730242 0.79 CHRM4 (0.68) CHRM4CHRM2CHRM1CHRM5CHRM3
SCHEMBL1727464 0.78 HRH3 (0.42) CHRM4CHRM2CHRM1
SCHEMBL1723002 0.78 RET (0.43) CHRM4CHRM2CHRM1CHRM5CHRM3

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 5 patents. 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
EP-2356108-B1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-10-15 EP disclosed
US-8716289-B2 Carbamate derivatives of alkyl-heterocycles, preparation thereof and therapeutic use thereof SANOFI (FR) 2014-05-06 US disclosed
EP-2356108-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-08-17 EP disclosed
WO-2010055267-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-05-20 WO disclosed