SCHEMBL17872154

SCHEMBL17872154

NCCC[C@@H](C(=O)O)N(CCN)CCN

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 6/20 0.44
GSR P00390 1/20 0.42
RNPEP Q9H4A4 1/20 0.41
GABRR1 P24046 3/20 0.35
LMNA P02545 2/20 0.34
THRB P10828 2/20 0.34
BLM P54132 2/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
GABRR3 A8MPY1 1/20 0.34
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
HDAC3 O15379 1/20 0.34
GABBR2 O75899 1/20 0.34
CYP1A2 P05177 1/20 0.34
GABRA1 P14867 1/20 0.34
TSHR P16473 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34

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
SCHEMBL17872153 1.00 CPB2 (0.44) CPB2GSRRNPEPGABRR1LMNA
SCHEMBL6859337 0.86 GSR (0.50) CPB2GSRRNPEPGABRR1LMNA
SCHEMBL6859332 0.86 GSR (0.50) CPB2GSRRNPEPGABRR1LMNA
SCHEMBL129873 0.83 GRIK1 (0.47) NOD1
SCHEMBL22433660 0.83 NOD1 (0.44) GABRR1NOD1
SCHEMBL10878349 0.83 GRIK1 (0.47) NOD1
SCHEMBL1830577 0.83 GRIK1 (0.47) NOD1
SCHEMBL11256357 0.83 GRIK1 (0.47) NOD1
SCHEMBL608197 0.83 GRIK1 (0.47) NOD1
SCHEMBL18286753 0.83 CPB2 (0.33) CPB2GSRRNPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10434186-B2 Functionalized linear ligands and complexes thereof LUMIPHORE, INC. (US) 2019-10-08 US disclosed
US-20170360956-A1 FUNCTIONALIZED LINEAR LIGANDS AND COMPLEXES THEREOF LUMIPHORE, INC. 2017-12-21 US disclosed
EP-3237429-A1 FUNCTIONALIZED LINEAR LIGANDS AND COMPLEXES THEREOF Lumiphore, Inc. (US) 2017-11-01 EP disclosed
WO-2016106241-A1 FUNCTIONALIZED LINEAR LIGANDS AND COMPLEXES THEREOF LUMIPHORE, INC. (US) 2016-06-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170360956-A1 FUNCTIONALIZED LINEAR LIGANDS AND COMPLEXES THEREOF CLTB, CLTA, EPCAM CPB2 1611/4885GSR 2283/4885RNPEP 766/4885
US-10434186-B2 Functionalized linear ligands and complexes thereof CLTB, CLTA, EPCAM CPB2 1611/4885GSR 2283/4885RNPEP 766/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.