SCHEMBL8634133

SCHEMBL8634133

COC(=O)C(CC(N)C(=O)OC(C)(C)C)C(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.36
CA14 Q9ULX7 2/20 0.36
DGAT1 O75907 1/20 0.35
LTA4H P09960 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NOS1 P29475 2/20 0.34
NOS3 P29474 1/20 0.34
NOS2 P35228 1/20 0.34
MME P08473 1/20 0.32
CA2 P00918 3/20 0.32
CA1 P00915 2/20 0.32
CA7 P43166 1/20 0.32
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
SLC1A1 P43005 1/20 0.31
SLC7A5 Q01650 1/20 0.31
PSMB5 P28074 1/20 0.30
APLNR P35414 1/20 0.30

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
SCHEMBL27596147 0.89 CA12 (0.38) CA12CA14DGAT1LTA4HSMN1; SMN2
Hydrochloric Acid SCHEMBL28464794 0.87 CA12 (0.37) CA12CA14DGAT1LTA4HSMN1; SMN2
SCHEMBL569252 0.84 NOS1 (0.39) CA12DGAT1LTA4HNOS1NOS3
SCHEMBL1003437 0.83 SLC7A5 (0.38) LTA4HNOS1NOS3NOS2MEN1
SCHEMBL5199190 0.82 CA12 (0.34) CA12CA14DGAT1NOS1NOS3
Hydrochloric Acid SCHEMBL20243055 0.82 NOS1 (0.38) CA12DGAT1LTA4HNOS1NOS3
SCHEMBL3594439 0.81 LTA4H (0.41) CA12CA14DGAT1LTA4HSMN1; SMN2
SCHEMBL8639283 0.81 LTA4H (0.41) CA12CA14DGAT1LTA4HSMN1; SMN2
Hydrochloric Acid SCHEMBL4910187 0.79 LTA4H (0.40) CA12CA14DGAT1LTA4HNOS1
SCHEMBL14666479 0.79 CA12 (0.38) CA12CA14DGAT1LTA4HNOS1

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
US-5773465-A Tartronic acids, their acetalic ethers and o-esters DOMPE FARMACEUTICI S.P.A. (IT) 1998-06-30 US disclosed
US-5656656-A Tartronic acids, their acetalic ethers and O-esters DOMPE FARMACEUTICI S.P.A. (IT) 1997-08-12 US disclosed
EP-0667850-B1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE FARMACEUTICI SPA (IT) 1997-05-28 EP disclosed
EP-0667850-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS. DOMPE FARMACEUTICI SPA (IT) 1995-08-23 EP disclosed
WO-1994010127-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE' FARMACEUTICI S.P.A. (IT) 1994-05-11 WO disclosed