SCHEMBL19975767

SCHEMBL19975767

CC(=O)N[C@@H](CCCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.48
SIRT1 Q96EB6 1/20 0.48
FOLH1 Q04609 1/20 0.44
SIRT5 Q9NXA8 3/20 0.44
ALB P02768 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GNPAT O15228 1/20 0.41
NOD1 Q9Y239 1/20 0.40
GLP1R P43220 5/20 0.38
NPY1R P25929 3/20 0.38
NPY2R P49146 3/20 0.38
NPY4R P50391 3/20 0.38
NPY5R Q15761 3/20 0.38
C3AR1 Q16581 1/20 0.38

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
SCHEMBL17732656 0.91 GNPAT (0.47) SIRT6SIRT1FOLH1SIRT5ALB
SCHEMBL1886040 0.87 FOLH1 (0.47) FOLH1SIRT5ALBSMN1; SMN2GNPAT
SCHEMBL468736 0.87 FOLH1 (0.55) SIRT6SIRT1FOLH1SIRT5ALB
SCHEMBL29550463 0.87 FOLH1 (0.55) SIRT6SIRT1FOLH1SIRT5ALB
SCHEMBL22769501 0.87 FOLH1 (0.55) SIRT6SIRT1FOLH1SIRT5ALB
SCHEMBL29875551 0.86 C3AR1 (0.40) SIRT6SIRT1GNPATNOD1NPY1R
SCHEMBL29454444 0.86 GNPAT (0.53) SIRT6SIRT1FOLH1SIRT5ALB
SCHEMBL31094973 0.86 GNPAT (0.53) SIRT6SIRT1FOLH1SIRT5ALB
SCHEMBL1718474 0.86 GNPAT (0.53) SIRT6SIRT1FOLH1SIRT5ALB
SCHEMBL29655002 0.86 GNPAT (0.53) SIRT6SIRT1FOLH1SIRT5ALB

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-9920082-B2 Water-soluble complexing agents and corresponding lanthanide complexes CISBO BIOASSAYS (FR) 2018-03-20 US disclosed