SCHEMBL2228017

SCHEMBL2228017

CCN1CCCC1CNC(=O)c1ccc2c(Cl)c3c(nc2c1)CCCC3.CN(C)CC(C)(C)CNC(=O)c1ccc2c(Cl)c3c(nc2c1)CCCC3

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
TP53 P04637 2/20 0.52
ALDH1A1 P00352 4/20 0.52
MAPK1 P28482 1/20 0.52
KMT2A Q03164 7/20 0.51
MEN1 O00255 5/20 0.51
HTT P42858 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
GAA P10253 1/20 0.50
GFER P55789 1/20 0.50
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
USP7 Q93009 1/20 0.48
SMYD3 Q9H7B4 1/20 0.48

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
SCHEMBL2228012 1.00 MAPT (0.52) MAPTTP53ALDH1A1MAPK1KMT2A
SCHEMBL2227598 0.90 MAPT (0.62) MAPTTP53ALDH1A1MAPK1KMT2A
SCHEMBL2220853 0.90 MAPT (0.62) MAPTTP53ALDH1A1MAPK1KMT2A
SCHEMBL2230042 0.90 MAPT (0.62) MAPTTP53ALDH1A1MAPK1KMT2A
SCHEMBL2226684 0.87 MAPT (0.64) MAPTTP53ALDH1A1KMT2AMEN1
SCHEMBL15988228 0.77 ALDH1A1 (0.49) MAPTTP53ALDH1A1MAPK1KMT2A
SCHEMBL2228666 0.75 KMT2A (0.68) MAPTTP53ALDH1A1MAPK1KMT2A
SCHEMBL14651035 0.73 MAPT (0.57) MAPTTP53ALDH1A1MAPK1KMT2A
SCHEMBL2217604 0.73 SMN1; SMN2 (0.75) MAPTTP53ALDH1A1KMT2AMEN1
SCHEMBL13822539 0.71 MAPT (0.65) MAPTTP53ALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2523938-A1 AMIDOACRIDINE DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 7 Hybrigenics S.A. (FR) 2012-11-21 EP claimed
WO-2011086178-A1 AMIDOACRIDINE DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 7 HYBRIGENICS SA (FR) 2011-07-21 WO claimed
EP-2523938-A1 AMIDOACRIDINE DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 7 Hybrigenics S.A. (FR) 2012-11-21 EP disclosed
WO-2011086178-A1 AMIDOACRIDINE DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 7 HYBRIGENICS SA (FR) 2011-07-21 WO disclosed