SCHEMBL5656185

SCHEMBL5656185

CCCCCCCCCCCCNC(=O)[C@H](CS)NC(C)=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.65
SIRT1 Q96EB6 1/20 0.65
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.50
KDM4E B2RXH2 1/20 0.49
MAPT P10636 1/20 0.49
THRB P10828 1/20 0.49
ALOX15 P16050 1/20 0.49
NFKB1 P19838 1/20 0.49
PTGS2 P35354 1/20 0.49
THPO P40225 1/20 0.49
RECQL P46063 1/20 0.49
BLM P54132 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
EPHX1 P07099 6/20 0.47
RRM1 P23921 1/20 0.46
DPP7 Q9UHL4 2/20 0.46
LPAR3 Q9UBY5 4/20 0.46

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
SCHEMBL14682789 0.98 SIRT6 (0.62) SIRT6SIRT1MEN1ALDH1A1HPGD
SCHEMBL14471244 0.93 SIRT6 (0.56) SIRT6SIRT1MEN1ALDH1A1HPGD
SCHEMBL929209 0.87 KDM4E (0.52) SIRT6SIRT1MEN1ALDH1A1HPGD
SCHEMBL12157363 0.86 KDM4E (0.55) SIRT6SIRT1MEN1ALDH1A1HPGD
SCHEMBL19860488 0.86 SIRT6 (0.49) SIRT6SIRT1MEN1ALDH1A1HPGD
SCHEMBL506609 0.85 SIRT6 (0.67) SIRT6SIRT1MEN1ALDH1A1HPGD
SCHEMBL506608 0.85 SIRT6 (0.67) SIRT6SIRT1MEN1ALDH1A1HPGD
SCHEMBL930076 0.85 KDM4E (0.53) SIRT6SIRT1MEN1ALDH1A1HPGD
SCHEMBL4390415 0.84 SIRT6 (0.48) SIRT6SIRT1MEN1ALDH1A1HPGD
SCHEMBL4395359 0.84 SIRT6 (0.48) SIRT6SIRT1MEN1ALDH1A1HPGD

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1120407-B1 Cystine derivatives AJINOMOTO KK (JP) 2013-02-20 EP disclosed
US-7105570-B2 Cysteine derivatives AJINOMOTO CO., INC. (JP) 2006-09-12 US disclosed
US-6703031-B1 OXIDATIVE STRESS INHIBITOR; RETARDING AGING OF SKIN AJINOMOTO CO., INC. (JP) 2004-03-09 US disclosed
US-6602492-B2 Cysteine derivatives AJINOMOTO CO., INC. (JP) 2003-08-05 US disclosed
EP-1120407-A1 CYSTEINE DERIVATIVES Ajinomoto Co., Inc. (JP) 2001-08-01 EP disclosed