SCHEMBL2227707

SCHEMBL2227707

CCN(CC)CCCC(C)NC(=O)c1ccc2c(Cl)c3c(nc2c1)CCCC3.O=C(NCC1CCN(CCc2ccccc2)CC1)c1ccc2c(Cl)c3c(nc2c1)CCCC3

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 4/20 0.59
SMN1; SMN2 Q16637 2/20 0.57
TP53 P04637 2/20 0.57
HTT P42858 1/20 0.57
MEN1 O00255 5/20 0.52
KMT2A Q03164 5/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
GAA P10253 1/20 0.51
GFER P55789 1/20 0.51
MAPT P10636 5/20 0.50
ALDH1A1 P00352 1/20 0.50
USP10 Q14694 1/20 0.46

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
SCHEMBL2227045 0.87 KMT2A (0.62) USP7SMN1; SMN2TP53HTTMEN1
SCHEMBL2229244 0.84 KMT2A (0.65) USP7SMN1; SMN2TP53HTTMEN1
SCHEMBL2229385 0.84 SMN1; SMN2 (0.74) USP7SMN1; SMN2TP53HTTMEN1
SCHEMBL2225718 0.83 KMT2A (0.62) USP7SMN1; SMN2TP53HTTMEN1
SCHEMBL2228184 0.81 KMT2A (0.60) USP7SMN1; SMN2TP53HTTMEN1
SCHEMBL2219299 0.76 MAPT (0.58) USP7SMN1; SMN2TP53HTTMEN1
SCHEMBL14651035 0.75 MAPT (0.57) USP7SMN1; SMN2TP53HTTMEN1
SCHEMBL2221299 0.75 USP7 (1.00) USP7SMN1; SMN2TP53HTTMEN1
SCHEMBL2218247 0.74 SMN1; SMN2 (1.00) USP7SMN1; SMN2TP53HTTMEN1
SCHEMBL13822345 0.74 MAPT (0.60) SMN1; SMN2TP53HTTMEN1KMT2A

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 2 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 disclosed
WO-2011086178-A1 AMIDOACRIDINE DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 7 HYBRIGENICS SA (FR) 2011-07-21 WO disclosed