SCHEMBL29706366

SCHEMBL29706366

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.50
FOLH1 Q04609 1/20 0.47
CPB2 Q96IY4 3/20 0.45
ACE P12821 1/20 0.45
DPP8 Q6V1X1 1/20 0.45
DPP9 Q86TI2 1/20 0.45
DPP7 Q9UHL4 1/20 0.45
MMP2 P08253 1/20 0.42
GNAI3 P08754 1/20 0.41
GNAO1 P09471 1/20 0.41
GNAI1 P63096 1/20 0.41
RNPEP Q9H4A4 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
ALOX15 P16050 1/20 0.41
NFKB1 P19838 1/20 0.41
PTGS2 P35354 1/20 0.41
THPO P40225 1/20 0.41
RECQL P46063 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
SCHEMBL30239244 0.96 FOLH1 (0.49) GSRFOLH1CPB2ACEDPP8
SCHEMBL16770238 0.95 GSR (0.51) GSRFOLH1CPB2ACEDPP8
SCHEMBL29963837 0.95 GSR (0.51) GSRFOLH1CPB2ACEDPP8
SCHEMBL21828643 0.95 GSR (0.55) GSRFOLH1CPB2ACEDPP8
SCHEMBL14957758 0.95 GSR (0.55) GSRFOLH1CPB2ACEDPP8
SCHEMBL28326503 0.95 GSR (0.55) GSRFOLH1CPB2ACEDPP8
SCHEMBL29517180 0.95 GSR (0.55) GSRFOLH1CPB2ACEDPP8
SCHEMBL31233819 0.94 FOLH1 (0.47) GSRFOLH1CPB2ACERNPEP
SCHEMBL30671932 0.94 GSR (0.50) GSRFOLH1CPB2ACEDPP8
Hydrochloric Acid SCHEMBL28326501 0.94 GSR (0.53) GSRFOLH1CPB2ACEDPP8

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
US-20220218839-A1 SELECTIVE UV CROSSLINKING OF PEPTIDES AND FUNCTIONAL MOIETIES TO IMMUNOGLOBULINS UNIVERSITY OF NOTRE DAME DU LAC (US) 2022-07-14 US disclosed
US-20220195501-A1 Targeted Sequence Detection by Nanopore Sensing of Synthetic Probes NOOMA BIO, LLC 2022-06-23 US disclosed