SCHEMBL7556901

SCHEMBL7556901

CC(=O)N[C@@H](CCCCN)C(=O)O.CNCCCC[C@@H](C(=O)O)N(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.47
SIRT1 Q96EB6 1/20 0.47
FOLH1 Q04609 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.40
GNPAT O15228 2/20 0.40
SLC6A5 Q9Y345 1/20 0.39
ITGB3 P05106 3/20 0.38
ITGA2B P08514 3/20 0.38
ALB P02768 2/20 0.38
CPB2 Q96IY4 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
PAOX Q6QHF9 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.36
NFKB1 P19838 1/20 0.36
PTGS2 P35354 1/20 0.36
THPO P40225 1/20 0.36

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
SCHEMBL546909 0.88 GSR (0.42) SIRT6SIRT1FOLH1CPB2PAOX
SCHEMBL13595628 0.82 FOLH1 (0.54) SIRT6SIRT1FOLH1SMN1; SMN2GNPAT
SCHEMBL21673279 0.82 FOLH1 (0.54) SIRT6SIRT1FOLH1SMN1; SMN2GNPAT
SCHEMBL20530 0.81 FOLH1 (0.62) SIRT6SIRT1FOLH1SMN1; SMN2GNPAT
SCHEMBL20529 0.81 FOLH1 (0.62) SIRT6SIRT1FOLH1SMN1; SMN2GNPAT
SCHEMBL919220 0.81 FOLH1 (0.62) SIRT6SIRT1FOLH1SMN1; SMN2GNPAT
SCHEMBL97745 0.81 CPB2 (0.41) FOLH1CPB2
SCHEMBL16238796 0.79 FOLH1 (0.60) SIRT6SIRT1FOLH1SMN1; SMN2GNPAT
Hydrochloric Acid SCHEMBL15669796 0.79 FOLH1 (0.60) SIRT6SIRT1FOLH1SMN1; SMN2GNPAT
SCHEMBL31621381 0.79 FOLH1 (0.60) SIRT6SIRT1FOLH1SMN1; SMN2GNPAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020187522-A1 DNA encoding human Cid1 ABBOTT LABORATORIES 2002-12-12 US disclosed
US-20020127556-A1 DNA encoding human Cid2 ABBOTT LABORATORIES 2002-09-12 US disclosed
WO-2002070554-A2 DNA ENCODING HUMAN CID2 ABBOTT LABORATORIES (US) 2002-09-12 WO disclosed