SCHEMBL19975587

SCHEMBL19975587

CC(=O)CN(CCCC[C@H](NC(=O)[C@H](CCCCN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O)C(=O)O)CC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 3/20 0.37
FOLH1 Q04609 6/20 0.35
NOD1 Q9Y239 2/20 0.34
TDP1 Q9NUW8 2/20 0.32
EYA2 O00167 1/20 0.32
APP P05067 1/20 0.32
ACE P12821 1/20 0.32
MME P08473 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
CHRM2 P08172 1/20 0.31
ADRA2A P08913 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
DRD1 P21728 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
CYP2C19 P33261 1/20 0.31
ADRA1A P35348 1/20 0.31
DRD3 P35462 1/20 0.31

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
SCHEMBL19975584 0.94 FOLH1 (0.36) GNPATFOLH1NOD1TDP1EYA2
SCHEMBL19970336 0.94 FOLH1 (0.36) GNPATFOLH1NOD1TDP1EYA2
SCHEMBL21032736 0.88 FOLH1 (0.51) GNPATFOLH1ADRA1ASMN1; SMN2
SCHEMBL21031586 0.88 FOLH1 (0.47) GNPATFOLH1CPB2
SCHEMBL21032104 0.82 GLP1R (0.41) FOLH1NOD1
SCHEMBL21534104 0.81 GLP1R (0.48) FOLH1NOD1
SCHEMBL21534085 0.80 FOLH1 (0.35) FOLH1NOD1SMN1; SMN2CPB2
SCHEMBL19975586 0.77 CTSK (0.34) GNPATNOD1TSHR
SCHEMBL5949922 0.76 TDP1 (0.46) TDP1EYA2APPACEKDM4E
SCHEMBL14906324 0.75 NOD1 (0.54) FOLH1NOD1MME

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-9920092-B1 Composition having anti-oxidant, anti-aging, and autophagy activities and uses thereof INCOSPHARM CORPORATION (KR) 2018-03-20 US disclosed