SCHEMBL1727733

SCHEMBL1727733

CNC(CN(CC=O)C(=O)O)N1CCN(c2cccc(-c3cccc(OC)c3)n2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.45
MAPT P10636 10/20 0.40
LMNA P02545 8/20 0.40
ALDH1A1 P00352 7/20 0.40
SMN1; SMN2 Q16637 6/20 0.40
MAPK1 P28482 5/20 0.39
HTT P42858 4/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
TP53 P04637 3/20 0.39
GAA P10253 2/20 0.39
KDM4E B2RXH2 2/20 0.38
HPGD P15428 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 2/20 0.38
CNR2 P34972 1/20 0.38

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
SCHEMBL1727878 0.92 PDE4A (0.39) CNR1MAPTSMN1; SMN2PIM1PIM2
SCHEMBL1730374 0.91 CNR1 (0.44) CNR1MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL1727719 0.89 CNR1 (0.46) CNR1KMT2APIM1PIM2CNR2
SCHEMBL1730290 0.89 CNR1 (0.43) CNR1MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL1728846 0.87 CNR1 (0.43) CNR1PIM1PIM2
SCHEMBL1730220 0.86 EGLN1 (0.45) LMNAALDH1A1SMN1; SMN2MAPK1HTT
SCHEMBL1727694 0.85 CNR1 (0.41) CNR1MAPTLMNASMN1; SMN2MAPK1
SCHEMBL1729333 0.85 SUCNR1 (0.40) CNR1
SCHEMBL1727868 0.83 CNR1 (0.43) CNR1PIM1PIM2
SCHEMBL1729810 0.80 CNR1 (0.42) CNR1MAPTLMNAALDH1A1SMN1; SMN2

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