SCHEMBL13822709

SCHEMBL13822709

NCCCN1CCCC1.O=C(O)c1ccc2c(Cl)c3c(nc2c1)CCCC3

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.70
MEN1 O00255 3/20 0.70
SMN1; SMN2 Q16637 2/20 0.70
GAA P10253 1/20 0.70
GFER P55789 1/20 0.70
MAPT P10636 5/20 0.69
ALDH1A1 P00352 3/20 0.69
HTT P42858 2/20 0.54
SMYD3 Q9H7B4 6/20 0.54
LMNA P02545 1/20 0.53
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
TP53 P04637 1/20 0.51

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
SCHEMBL2227997 0.90 KMT2A (0.68) KMT2AMEN1SMN1; SMN2GAAGFER
SCHEMBL13822707 0.88 KMT2A (0.65) KMT2AMEN1SMN1; SMN2GAAGFER
SCHEMBL2218702 0.84 MAPT (0.72) KMT2ASMN1; SMN2MAPTALDH1A1HTT
SCHEMBL2228741 0.83 MAPT (0.70) KMT2AMEN1SMN1; SMN2MAPTALDH1A1
SCHEMBL2219175 0.82 KMT2A (1.00) KMT2AMEN1SMN1; SMN2GAAGFER
SCHEMBL2227878 0.82 SMN1; SMN2 (0.70) KMT2AMEN1SMN1; SMN2MAPTALDH1A1
SCHEMBL2227938 0.81 KMT2A (0.68) KMT2AMEN1SMN1; SMN2MAPTALDH1A1
SCHEMBL2227633 0.79 MAPT (0.89) KMT2AMEN1SMN1; SMN2GAAGFER
SCHEMBL13822374 0.79 MAPT (0.89) KMT2AMEN1SMN1; SMN2GAAGFER
SCHEMBL2229536 0.79 MAPT (0.89) KMT2AMEN1SMN1; SMN2GAAGFER

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 claimed
EP-2523938-A1 AMIDOACRIDINE DERIVATIVES USEFUL AS SELECTIVE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 7 Hybrigenics S.A. (FR) 2012-11-21 EP disclosed