SCHEMBL2227997

SCHEMBL2227997

NCCCN1CCCC1.O=C(c1ccc2c(Cl)c3c(nc2c1)CCCC3)N1CCCCCC1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.68
MAPT P10636 5/20 0.68
MEN1 O00255 4/20 0.68
ALDH1A1 P00352 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.67
GAA P10253 1/20 0.67
GFER P55789 1/20 0.67
LMNA P02545 2/20 0.65
SMYD3 Q9H7B4 6/20 0.64
HTT P42858 1/20 0.63
TP53 P04637 2/20 0.60

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
SCHEMBL13822709 0.90 KMT2A (0.70) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL2227993 0.89 KMT2A (0.67) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL2228000 0.88 LMNA (0.80) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL2216711 0.88 LMNA (0.80) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL2226175 0.85 ALDH1A1 (0.68) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL2226172 0.81 ALDH1A1 (0.68) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL2219175 0.80 KMT2A (1.00) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL18706162 0.80 MAPT (0.79) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL18706418 0.79 ALDH1A1 (0.74) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL2221189 0.79 LMNA (1.00) KMT2AMAPTMEN1ALDH1A1SMN1; 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 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