SCHEMBL27460720

SCHEMBL27460720

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.39
GABRR1 P24046 2/20 0.39
LMNA P02545 1/20 0.39
FOLH1 Q04609 2/20 0.36
CACNA2D1 P54289 2/20 0.32
CACNB3 P54284 1/20 0.32
CACNA1C Q13936 1/20 0.32
PGR P06401 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
CACNA2D2 Q9NY47 1/20 0.32
GRM8 O00222 1/20 0.32
GRM6 O15303 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GSR P00390 1/20 0.32
CYP1A2 P05177 1/20 0.32
GRIK1 P39086 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
SCHEMBL27736639 0.80 TDP1 (0.40) TDP1SMN1; SMN2SLC22A6GABRR1LMNA
SCHEMBL27736638 0.80 TDP1 (0.40) TDP1SMN1; SMN2SLC22A6GABRR1LMNA
Hydrochloric Acid SCHEMBL7497803 0.80 TDP1 (0.40) TDP1SMN1; SMN2SLC22A6GABRR1LMNA
SCHEMBL27562063 0.78 TDP1 (0.39) TDP1SMN1; SMN2SLC22A6GABRR1LMNA
SCHEMBL6323189 0.78 TDP1 (0.48) TDP1SMN1; SMN2SLC22A6GABRR1LMNA
SCHEMBL20206 0.76 TDP1 (0.46) TDP1SMN1; SMN2SLC22A6GABRR1LMNA
SCHEMBL27715459 0.76
SCHEMBL29650586 0.76 TDP1 (0.46) TDP1SMN1; SMN2SLC22A6GABRR1LMNA
SCHEMBL31434997 0.76 TDP1 (0.46) TDP1SMN1; SMN2SLC22A6GABRR1LMNA
SCHEMBL8583491 0.75 CYP1A2 (0.50) LMNAFOLH1GRM8GRM6GRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113661046-A Co-reactive three-dimensional printing of parts PPG工业俄亥俄公司 2021-11-16 CN disclosed
CN-103635501-A Pavement marking composition system 3M INNOVATIVE PROPERTIES CO 2014-03-12 CN disclosed
CN-1968982-A Pavement marking comprising modified isocyanate 3M INNOVATIVE PROPERTIES CO (US) 2007-05-23 CN disclosed
CN-1128170-C Liquid pavement marking composation MINNESOTA MINING & MFG (US) 2003-11-19 CN disclosed
CN-1260808-A Liquid pavement marking composation MINNESOTA MINING & MFG (US) 2000-07-19 CN disclosed