SCHEMBL11528386

SCHEMBL11528386

CCNCc1ccc(N(CC)CC)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.58
ALDH1A1 P00352 6/20 0.57
GFER P55789 4/20 0.57
MAPK1 P28482 4/20 0.57
RECQL P46063 2/20 0.57
CNR2 P34972 4/20 0.54
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
PANK3 Q9H999 1/20 0.51
MAPT P10636 3/20 0.50
ALDH3A1 P30838 1/20 0.50
ALDH1A3 P47895 1/20 0.50
PSMD14 O00487 1/20 0.48
CYP3A4 P08684 1/20 0.48
TSHR P16473 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KDM4E B2RXH2 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 1/20 0.47

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
SCHEMBL11044474 0.88 LMNA (0.68) LMNAALDH1A1GFERMAPK1RECQL
SCHEMBL11529730 0.84 LMNA (0.44) LMNAALDH1A1GFERMAPK1RECQL
SCHEMBL11529218 0.84 LMNA (0.64) LMNAALDH1A1GFERMAPK1RECQL
SCHEMBL9180552 0.82 LMNA (0.52) LMNAALDH1A1MEN1KMT2ATDP1
SCHEMBL11529878 0.81 LMNA (0.60) LMNAALDH1A1GFERMAPK1RECQL
SCHEMBL20161350 0.81 HRH4 (0.44) LMNAALDH1A1GFERMAPK1RECQL
SCHEMBL14036484 0.81 LMNA (0.44) LMNAALDH1A1GFERMAPK1RECQL
SCHEMBL1038338 0.81 ALDH1A1 (0.54) ALDH1A1MAPK1MEN1KMT2AMAPT
SCHEMBL11532602 0.81 CNR2 (0.56) LMNAALDH1A1GFERMAPK1RECQL
SCHEMBL11528378 0.80 HRH4 (0.66) LMNAALDH1A1GFERMAPK1RECQL

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
US-4157343-A Preparation of aromatic diamines UOP INC. (US) 1979-06-05 US disclosed