SCHEMBL1730153

SCHEMBL1730153

O=C(O)NCCC1CCN(c2ncccc2-c2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 5/20 0.52
NSD2 O96028 4/20 0.48
P2RX7 Q99572 1/20 0.46
HTR1A P08908 2/20 0.44
DRD2 P14416 2/20 0.44
HTR7 P34969 2/20 0.44
HTR6 P50406 2/20 0.44
LRRK2 Q5S007 1/20 0.43
SIRT2 Q8IXJ6 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
SIRT3 Q9NTG7 1/20 0.43
RBP4 P02753 1/20 0.42
TTR P02766 1/20 0.42
MALT1 Q9UDY8 1/20 0.42

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
SCHEMBL1728967 0.91 NSD2 (0.47) CHRM4NSD2P2RX7HTR1ADRD2
SCHEMBL1727773 0.88 P2RX7 (0.54) P2RX7HTR1ADRD2HTR7HTR6
SCHEMBL3265672 0.85 CHRM4 (0.45) CHRM4NSD2P2RX7HTR1ADRD2
SCHEMBL1730203 0.84 CHRM4 (0.51) CHRM4NSD2SIRT2SIRT1SIRT3
SCHEMBL1727887 0.83 KDM4E (0.60) CHRM4DRD2MALT1
SCHEMBL1728813 0.81 SIRT2 (0.51) CHRM4DRD2SIRT2SIRT1SIRT3
SCHEMBL1727778 0.80 P2RX7 (0.53) P2RX7HTR1ADRD2HTR7HTR6
SCHEMBL1727561 0.80 KMT2A (0.48) P2RX7MALT1
SCHEMBL1727741 0.80 CHRM4 (0.56) CHRM4DRD2
SCHEMBL1729606 0.77 CHRM4 (0.57) CHRM4

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