SCHEMBL8424240

SCHEMBL8424240

CC(O)CN[C@@H](CC(=O)O)C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.34
GABRR1 P24046 2/20 0.34
LMNA P02545 1/20 0.34
CACNA2D1 P54289 2/20 0.33
CACNB3 P54284 1/20 0.33
CACNA1C Q13936 1/20 0.33
PGR P06401 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
CACNA2D2 Q9NY47 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
ENPEP Q07075 2/20 0.32
ECE1 P42892 1/20 0.32

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
Aspartic Acid SCHEMBL8450005 0.90 SLC7A5 (0.39)
SCHEMBL2915366 0.84 CA2 (0.43) SLC22A6CA2CA4SMN1; SMN2
SCHEMBL2915369 0.84 CA2 (0.43) SLC22A6CA2CA4SMN1; SMN2
SCHEMBL27383424 0.82 CA2 (0.42) SLC22A6CA2CA4SMN1; SMN2
SCHEMBL8422815 0.79 SLC22A6 (0.43) SLC22A6GABRR1LMNASMN1; SMN2
SCHEMBL8450154 0.78 ITGB3 (0.34) SLC22A6GABRR1LMNACACNA2D1CACNB3
SCHEMBL17773049 0.78 ITGB3 (0.34) SLC22A6GABRR1LMNACACNA2D1CACNB3
SCHEMBL11119411 0.76 SLC22A6 (0.37) SLC22A6GABRR1LMNACACNA2D1CACNB3
SCHEMBL20375586 0.76 SLC22A6 (0.37) SLC22A6GABRR1LMNACACNA2D1CACNB3
SCHEMBL15186078 0.76 ECE1 (0.41) SLC22A6GABRR1CA2CA4ENPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5858244-A COPOLYMER COMPRISING AT LEAST ONE OF N-OXYGENATEDHYDROCARBONAMIDE MONOMERS AND AT LEAST ONE OF AMINO ACID MONOMERS, POLYSUCCINIMIDES NALCO CHEMICAL COMPANY (US) 1999-01-12 US claimed
US-5776875-A Use of biodegradable polymers in preventing scale build-up NALCO CHEMICAL COMPANY (US) 1998-07-07 US claimed
EP-0831066-A1 Biodegradable Aspartic acid polymers for preventing scale formation in boilers NALCO CHEMICAL COMPANY (US) 1998-03-25 EP claimed
EP-0819653-A2 Use of biodegradable polymers in preventing scale build-up NALCO CHEMICAL COMPANY (US) 1998-01-21 EP claimed
US-5858244-A COPOLYMER COMPRISING AT LEAST ONE OF N-OXYGENATEDHYDROCARBONAMIDE MONOMERS AND AT LEAST ONE OF AMINO ACID MONOMERS, POLYSUCCINIMIDES NALCO CHEMICAL COMPANY (US) 1999-01-12 US disclosed
US-5776875-A Use of biodegradable polymers in preventing scale build-up NALCO CHEMICAL COMPANY (US) 1998-07-07 US disclosed
EP-0819653-A2 Use of biodegradable polymers in preventing scale build-up NALCO CHEMICAL COMPANY (US) 1998-01-21 EP disclosed