SCHEMBL8632717

SCHEMBL8632717

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

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.41
CA12 O43570 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL9101886 0.83 DGAT1 (0.44) DGAT1CA12CA14CA1CA2
SCHEMBL27992931 0.78 DGAT1 (0.43) DGAT1
SCHEMBL27992932 0.78 DGAT1 (0.43) DGAT1
SCHEMBL27966695 0.77 DGAT1 (0.48) DGAT1CA12CA14CA2
SCHEMBL4794283 0.77 DGAT1 (0.48) DGAT1CA12CA14CA2
SCHEMBL4794280 0.77 DGAT1 (0.48) DGAT1CA12CA14CA2
SCHEMBL27575604 0.77 DGAT1 (0.48) DGAT1CA12CA14CA2
SCHEMBL28842397 0.77 DGAT1 (0.48) DGAT1CA12CA14CA1CA2
SCHEMBL27712307 0.76 DGAT1 (0.44) DGAT1
SCHEMBL30931647 0.76 CA1 (0.39) DGAT1CA12CA14CA1CA2

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