SCHEMBL6077347

SCHEMBL6077347

CCN(CC)CCCNC(=O)NCc1cccs1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
HPGD P15428 4/20 0.51
ALDH1A1 P00352 3/20 0.51
GAA P10253 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51
PKM P14618 1/20 0.51
HTT P42858 1/20 0.51
HSD17B10 Q99714 1/20 0.51
USP2 O75604 1/20 0.50
POLB P06746 1/20 0.49
NR1I3 Q14994 1/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 1/20 0.47

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
SCHEMBL6077207 0.91 LMNA (0.53) LMNAHPGDALDH1A1GAAMEN1
SCHEMBL6078444 0.81 LMNA (0.60) LMNAHPGDALDH1A1GAAMEN1
SCHEMBL14142610 0.80 LMNA (0.80) LMNAHPGDALDH1A1GAAMEN1
SCHEMBL6076056 0.79 ALDH1A1 (0.58) LMNAHPGDALDH1A1GAAMEN1
SCHEMBL6077138 0.79 LMNA (0.65) LMNAHPGDALDH1A1GAAMEN1
SCHEMBL6078071 0.78 ALDH1A1 (0.71) LMNAHPGDALDH1A1GAAMEN1
SCHEMBL24486834 0.78 LMNA (0.64) LMNAALDH1A1GAAMEN1KMT2A
SCHEMBL6075612 0.77 ALDH1A1 (0.58) LMNAHPGDALDH1A1GAAMEN1
SCHEMBL6076886 0.77 LMNA (0.46) LMNAALDH1A1GAAMEN1KMT2A
SCHEMBL7260964 0.76 ALDH1A1 (0.59) LMNAALDH1A1GAAKMT2ARAB9A

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
US-7098247-B2 Arylene-carboxylic acid (2-amino-phenyl)-amide derivatives HOFFMANN-LA ROCHE INC. (US) 2006-08-29 US disclosed