SCHEMBL2228568

SCHEMBL2228568

O=C(NCCCNCCc1ccccc1)c1ccc2c(Cl)c3c(nc2c1)CCCC3

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.72
USP7 Q93009 4/20 0.71
MEN1 O00255 4/20 0.66
KMT2A Q03164 4/20 0.66
SMN1; SMN2 Q16637 3/20 0.66
GAA P10253 1/20 0.66
GFER P55789 1/20 0.66
TP53 P04637 2/20 0.65
HTT P42858 1/20 0.65
ALDH1A1 P00352 1/20 0.65
USP10 Q14694 1/20 0.62
NPC1 O15118 2/20 0.62
RAB9A P51151 2/20 0.62

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
SCHEMBL20250621 0.85 USP7 (0.72) MAPTUSP7MEN1KMT2ASMN1; SMN2
SCHEMBL2222250 0.83 USP7 (1.00) MAPTUSP7MEN1KMT2ASMN1; SMN2
SCHEMBL2221299 0.82 USP7 (1.00) MAPTUSP7MEN1KMT2ASMN1; SMN2
SCHEMBL31069694 0.80 USP7 (0.97) MAPTUSP7MEN1KMT2ASMN1; SMN2
SCHEMBL2219175 0.79 KMT2A (1.00) MAPTUSP7MEN1KMT2ASMN1; SMN2
SCHEMBL2218247 0.79 SMN1; SMN2 (1.00) MAPTUSP7MEN1KMT2ASMN1; SMN2
SCHEMBL2229244 0.78 KMT2A (0.65) MAPTUSP7MEN1KMT2ASMN1; SMN2
SCHEMBL2217604 0.78 SMN1; SMN2 (0.75) MAPTUSP7MEN1KMT2ASMN1; SMN2
SCHEMBL31069697 0.78 MEN1 (0.96) MAPTUSP7MEN1KMT2ASMN1; SMN2
SCHEMBL31069695 0.78 MEN1 (0.96) MAPTUSP7MEN1KMT2ASMN1; SMN2

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