SCHEMBL19987936

SCHEMBL19987936

C=C(C)C(=O)OCCN[C@@H](CCCCN)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.40
GGT1 P19440 1/20 0.39
TLR2 O60603 2/20 0.39
TSHR P16473 3/20 0.39
THRB P10828 1/20 0.36
SIRT6 Q8N6T7 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
SLC6A5 Q9Y345 1/20 0.36
GSR P00390 1/20 0.36
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
RNPEP Q9H4A4 1/20 0.35
CPB2 Q96IY4 3/20 0.35
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CPB1 P15086 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
SCHEMBL20262990 0.82 TSHR (0.35) FOLH1GGT1TSHRTHRBITGB3
SCHEMBL20275938 0.82 TSHR (0.35) FOLH1GGT1TSHRTHRBITGB3
SCHEMBL21306475 0.82 FOLH1 (0.41) FOLH1TSHRTHRB
SCHEMBL19987934 0.81 TSHR (0.39) FOLH1TLR2TSHRSLC6A5GSR
SCHEMBL3789730 0.77 FOLH1 (0.44) FOLH1SIRT6SIRT1SLC6A5GSR
SCHEMBL610133 0.76 GGT1 (0.62) FOLH1GGT1TLR2SIRT6SIRT1
SCHEMBL6316197 0.76 FOLH1 (0.54) FOLH1GGT1TLR2SIRT6SIRT1
SCHEMBL7076576 0.76 FOLH1 (0.54) FOLH1GGT1TLR2SIRT6SIRT1
SCHEMBL610134 0.76 GGT1 (0.62) FOLH1GGT1TLR2SIRT6SIRT1
SCHEMBL148480 0.76 FOLH1 (0.54) FOLH1GGT1TLR2SIRT6SIRT1

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
EP-3299400-B1 LATEX FUNCTIONALIZED WITH STRUCTURAL UNITS OF AN AMINO ACID ROHM & HAAS (US) 2019-06-26 EP disclosed
US-10221309-B2 Latex functionalized with structural units of an amino acid ROHM AND HAAS COMPANY (US) 2019-03-05 US disclosed
US-20180086909-A1 LATEX FUNCTIONALIZED WITH STRUCTURAL UNITS OF AN AMINO ACID ROHM AND HAAS COMPANY 2018-03-29 US disclosed
EP-3299400-A1 LATEX FUNCTIONALIZED WITH STRUCTURAL UNITS OF AN AMINO ACID Rohm and Haas Company (US) 2018-03-28 EP disclosed