SCHEMBL1019433

SCHEMBL1019433

CC(C)N(C)C(=O)Nc1ccc(C(=O)N2CCN(Cc3cccc(C(=O)NC(C)(C)C)c3)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.46
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
PRKAB2 O43741 2/20 0.44
PRKAG1 P54619 2/20 0.44
PRKAA2 P54646 2/20 0.44
PRKAA1 Q13131 2/20 0.44
PRKAG3 Q9UGI9 2/20 0.44
PRKAG2 Q9UGJ0 2/20 0.44
PRKAB1 Q9Y478 2/20 0.44
TSHR P16473 2/20 0.44
PKM P14618 1/20 0.44
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ACKR3 P25106 5/20 0.43
MAPT P10636 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
SCHEMBL28052665 0.86 MEN1 (0.53) LMNAALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL1018777 0.85 MEN1 (0.57) LMNAALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL12955106 0.83 PRKAB2 (0.55) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL1019721 0.83 HIF1A (0.53) KDM4EMEN1KMT2APRKAB2PRKAG1
SCHEMBL1020459 0.82 PRKAB2 (0.47) LMNAALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL12954825 0.82 MEN1 (0.46) LMNAALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL1017900 0.81 MEN1 (0.53) LMNAALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL1021758 0.81 PRKAB2 (0.53) MEN1KMT2APRKAB2PRKAG1PRKAA2
SCHEMBL1020480 0.80 ACKR3 (0.47) LMNAALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL13660730 0.80 TP53 (0.49) LMNAALDH1A1KDM4ESMN1; SMN2GAA

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-2190827-B1 N-BENZYL-N'-ARYLCARBONYLPIPERAZINE DERIVATIVES AS LXR MODULATORS ORGANON NV (NL) 2011-01-12 EP disclosed
EP-2190827-A1 N-BENZYL, N' -ARYLCARBONYLPIPERAZINE DERIVATIVES AS LXR MODULATORS N.V. Organon (NL) 2010-06-02 EP disclosed
WO-2009024550-A1 N-BENZYL, N' -ARYLCARBONYLPIPERAZINE DERIVATIVES AS LXR MODULATORS N.V. ORGANON (NL) 2009-02-26 WO disclosed