SCHEMBL29569009

SCHEMBL29569009

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

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.46
MMP2 P08253 1/20 0.45
DPP8 Q6V1X1 1/20 0.45
DPP9 Q86TI2 1/20 0.45
DPP7 Q9UHL4 1/20 0.45
GNAI3 P08754 1/20 0.44
GNAO1 P09471 1/20 0.44
GNAI1 P63096 1/20 0.44
PTGS1 P23219 1/20 0.44
GSTK1 Q9Y2Q3 1/20 0.44
SIRT6 Q8N6T7 1/20 0.44
SIRT1 Q96EB6 1/20 0.44
NMT1 P30419 5/20 0.43
NMT2 O60551 4/20 0.43
FOLH1 Q04609 1/20 0.43
GLO1 Q04760 1/20 0.41
TERT O14746 1/20 0.41

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
SCHEMBL29569055 1.00 GSR (0.46) GSRMMP2DPP8DPP9DPP7
SCHEMBL29569320 1.00 GSR (0.46) GSRMMP2DPP8DPP9DPP7
SCHEMBL29568716 1.00 GSR (0.46) GSRMMP2DPP8DPP9DPP7
SCHEMBL29568828 0.99 GSR (0.45) GSRMMP2DPP8DPP9DPP7
SCHEMBL29397470 0.98 GSR (0.47) GSRMMP2DPP8DPP9DPP7
SCHEMBL29569500 0.95 PTGS1 (0.43) GSRMMP2DPP8DPP9DPP7
SCHEMBL29569082 0.95 PTGS1 (0.43) GSRMMP2DPP8DPP9DPP7
SCHEMBL29569342 0.95 PTGS1 (0.43) GSRMMP2DPP8DPP9DPP7
SCHEMBL30361223 0.93 FOLH1 (0.50) GSRMMP2DPP8DPP9DPP7
SCHEMBL4622026 0.92 FOLH1 (0.52) GSRMMP2DPP8DPP9DPP7

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

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