SCHEMBL3457786

SCHEMBL3457786

NCCCC[C@H](N)C(=O)OC(=O)CCC(=O)C(=O)OC(=O)[C@@H](N)CCCCN

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.44
GNAI3 P08754 1/20 0.34
GNAO1 P09471 1/20 0.34
GNAI1 P63096 1/20 0.34
DPP7 Q9UHL4 9/20 0.33
DPP8 Q6V1X1 5/20 0.33
DPP9 Q86TI2 5/20 0.33
DPP4 P27487 3/20 0.33
CPB2 Q96IY4 3/20 0.33
FOLH1 Q04609 1/20 0.33
RNPEP Q9H4A4 1/20 0.33
CYP1A2 P05177 1/20 0.33
FAP Q12884 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
SCHEMBL393523 0.95 GSR (0.38) GSRDPP7DPP8DPP9DPP4
SCHEMBL28782599 0.95 GSR (0.38) GSRDPP7DPP8DPP9DPP4
SCHEMBL2020673 0.92 GSR (0.43) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL5010331 0.90 GSR (0.53) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL1191631 0.90 GSR (0.53) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL29104362 0.89
Water SCHEMBL5501375 0.89 GSR (0.52) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL8836895 0.89 GSR (0.52) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL8836488 0.89 GSR (0.52) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL15566166 0.88 GSR (0.49) GSRGNAI3GNAO1GNAI1DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111812309-A Urine protein marker for tumor bone metastasis and application thereof 北京师范大学 2020-10-23 CN claimed
CN-111812309-A Urine protein marker for tumor bone metastasis and application thereof 北京师范大学 2020-10-23 CN disclosed
EP-3217807-A1 METHODS AND COMPOSITIONS FOR EGG WHITE PROTEIN PRODUCTION Clara Foods Co. (US) 2017-09-20 EP disclosed
WO-2016077457-A1 METHODS AND COMPOSITIONS FOR EGG WHITE PROTEIN PRODUCTION CLARA FOODS CO. (US) 2016-05-19 WO disclosed
US-20100124548-A1 Pharmaceutical product UNIVERSITY OF OULU (FI) 2010-05-20 US disclosed
WO-2010049590-A2 A NEW PHARMACEUTICAL PRODUCT OULUN YLIOPISTO (FI) 2010-05-06 WO disclosed
WO-2007030531-A2 REAGENTS FOR TESTING AND MOLECULAR IMAGING OF LIVER CANCER MOLECULAR IMAGE INC. (US) 2007-03-15 WO disclosed
EP-1402037-A1 PLANT GENES INVOLVED IN DEFENSE AGAINST PATHOGENS Syngenta Participations AG (CH) 2004-03-31 EP disclosed
WO-2003000898-A1 PLANT GENES INVOLVED IN DEFENSE AGAINST PATHOGENS SYNGENTA PARTICIPATIONS AG (CH) 2003-01-03 WO disclosed