SCHEMBL2288673

SCHEMBL2288673

CCN(CC)CCCC(C)NC(=O)c1cc(Cl)c2cc3c(nc2c1)CCCC3

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.49
TP53 P04637 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
LMNA P02545 1/20 0.45
CACNA2D1 P54289 4/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 2/20 0.43
USP7 Q93009 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
METAP2 P50579 2/20 0.40

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
SCHEMBL2229385 0.82 SMN1; SMN2 (0.74) HTTTP53SMN1; SMN2NPC1RAB9A
SCHEMBL2218247 0.66 SMN1; SMN2 (1.00) HTTTP53SMN1; SMN2NPC1RAB9A
SCHEMBL6068656 0.65 LMNA (0.71) HTTSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL2221128 0.64 SMN1; SMN2 (0.89) HTTTP53SMN1; SMN2NPC1RAB9A
SCHEMBL1543129 0.63 LMNA (0.52) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL2219477 0.62 KMT2A (0.96) HTTTP53SMN1; SMN2NPC1RAB9A
SCHEMBL2227878 0.62 SMN1; SMN2 (0.70) HTTTP53SMN1; SMN2NPC1RAB9A
SCHEMBL8288091 0.61 CACNA2D1 (1.00) CACNA2D1
SCHEMBL25226073 0.61 POLB (0.51) HTTSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL28956586 0.61 ACHE (0.40) HTTTP53SMN1; SMN2NPC1RAB9A

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