SCHEMBL2332843

SCHEMBL2332843

CC1(CCNC(=O)O)CCNCC1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
KMT2A Q03164 1/20 0.35
SMYD3 Q9H7B4 1/20 0.35
OPRM1 P35372 1/20 0.33

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
SCHEMBL3707047 0.81 SMYD3 (0.45) KDM4EKMT2ASMYD3OPRM1
SCHEMBL2330731 0.79 OPRM1 (0.35) KDM4EKMT2AOPRM1
SCHEMBL23579242 0.77 OPRM1 (0.34) KDM4EKMT2AOPRM1
SCHEMBL22495635 0.76 SMYD3 (0.42) KDM4EKMT2ASMYD3OPRM1
SCHEMBL2324649 0.75 CYP2D6 (0.36) KDM4EKMT2AOPRM1
SCHEMBL3713521 0.74 SMYD3 (0.37) KDM4EKMT2ASMYD3OPRM1
SCHEMBL21233081 0.74 KDM4E (0.32) KDM4EKMT2ASMYD3
SCHEMBL28485735 0.74 KDM4E (0.33) KDM4EKMT2ASMYD3OPRM1
SCHEMBL25477687 0.72 ADH1B (0.37)
SCHEMBL22434968 0.70 KDM4E (0.46) KDM4EKMT2AOPRM1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2356108-B1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-10-15 EP 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