SCHEMBL28124018

SCHEMBL28124018

C=C(C)C(=O)C(O)CC(Br)COP(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.43
PGK2 P07205 1/20 0.43
PGD P52209 5/20 0.38
MPI P34949 1/20 0.34
LPAR5 Q9H1C0 2/20 0.33
LPAR6 P43657 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR4 Q99677 1/20 0.33
LPAR2 Q9HBW0 1/20 0.33
LPAR3 Q9UBY5 1/20 0.33
ENPP2 Q13822 1/20 0.33

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
SCHEMBL11860852 0.83 PGK1 (0.57) PGK1PGK2PGDMPILPAR5
SCHEMBL27997830 0.82 PGK1 (0.55) PGK1PGK2PGDMPILPAR5
SCHEMBL28178398 0.79 TSHR (0.30)
SCHEMBL28194809 0.76 PGK1 (0.44) PGK1PGK2PGDMPILPAR5
SCHEMBL10765889 0.73 PGK1 (0.42) PGK1PGK2PGD
SCHEMBL28186199 0.71 S1PR1 (0.45) PGK1PGK2PGDMPI
SCHEMBL1614773 0.71 BTN3A1 (0.49) PGK1PGK2LPAR1LPAR3
SCHEMBL1426506 0.71 TSHR (0.42) PGK1PGK2PGDLPAR5LPAR6
SCHEMBL28303583 0.71 PGK1 (0.33) PGK1PGK2
Methacrylic Acid SCHEMBL28655463 0.69 PGK1 (0.52) PGK1PGK2PGDMPILPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106413665-B Adhering method, bonding kit utility and adhesives 德山齿科株式会社 2019-08-13 CN disclosed
CN-105101935-B Curable composition 可乐丽则武齿科株式会社 2018-02-23 CN disclosed
CN-106413665-A Bonding method, bonding kit, and bonding material 德山齿科株式会社 2017-02-15 CN disclosed