SCHEMBL1729264

SCHEMBL1729264

CNC(CN(CC=O)C(=O)O)C1CCN(c2cc3ccccc3cn2)CC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.41
CKS1B P61024 13/20 0.38
SKP1 P63208 13/20 0.38
SKP2 Q13309 13/20 0.38
CXCR3 P49682 1/20 0.35
KCNH2 Q12809 1/20 0.35
DGAT1 O75907 1/20 0.34

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
SCHEMBL1730142 0.90 ABL1 (0.37)
SCHEMBL1729779 0.89 SMO (0.34) CKS1BSKP1SKP2KCNH2DGAT1
SCHEMBL1730195 0.86 HCAR2 (0.46) HTR3ACKS1BSKP1SKP2
SCHEMBL1730251 0.86 DPP4 (0.42) HTR3ACKS1BSKP1SKP2CXCR3
SCHEMBL1727921 0.85 KDM4E (0.43)
SCHEMBL1727744 0.84 RXRA (0.43) CKS1BSKP1SKP2
SCHEMBL1728165 0.84 KDM4E (0.45) HTR3A
SCHEMBL1730128 0.84 HTR3A (0.43) HTR3A
SCHEMBL1727724 0.83 HSD11B1 (0.40) CKS1BSKP1SKP2
SCHEMBL1728682 0.82 ACACB (0.40) HTR3ACKS1BSKP1SKP2KCNH2

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