SCHEMBL29569319

SCHEMBL29569319

CCCC[C@H](NC(=O)[C@H](CCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCN)C(=O)NCC(=O)NCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 6/20 0.50
DPP8 Q6V1X1 5/20 0.50
DPP9 Q86TI2 5/20 0.50
DPP4 P27487 2/20 0.48
GNAI3 P08754 1/20 0.47
GNAO1 P09471 1/20 0.47
GNAI1 P63096 1/20 0.47
SIRT6 Q8N6T7 1/20 0.46
SIRT1 Q96EB6 1/20 0.46
NMT2 O60551 2/20 0.43
NMT1 P30419 2/20 0.43
SLC6A5 Q9Y345 1/20 0.41
ERAP2 Q6P179 2/20 0.41
TLR2 O60603 2/20 0.41
ERAP1 Q9NZ08 1/20 0.41
GLO1 Q04760 1/20 0.39
LNPEP Q9UIQ6 1/20 0.39
FAAH O00519 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39

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
SCHEMBL30445031 0.98 DPP7 (0.52) DPP7DPP8DPP9DPP4GNAI3
SCHEMBL29569342 0.93 PTGS1 (0.43) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL29569082 0.93 PTGS1 (0.43) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL29569500 0.93 PTGS1 (0.43) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL29568828 0.89 GSR (0.45) DPP7DPP8DPP9DPP4GNAI3
SCHEMBL31665964 0.88 NMT1 (0.50) NMT2NMT1TLR2
SCHEMBL29568716 0.88 GSR (0.46) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL29569009 0.88 GSR (0.46) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL29569320 0.88 GSR (0.46) DPP7DPP8DPP9GNAI3GNAO1
SCHEMBL29569055 0.88 GSR (0.46) DPP7DPP8DPP9GNAI3GNAO1

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
EP-3320923-B1 FLUORESCENT IMAGING AGENTS VISEN MEDICAL INC (US) 2022-04-06 EP disclosed