SCHEMBL8630438

SCHEMBL8630438

CCOC(=O)C(O)(CCCCCCN)C(=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.47
CYP4A11 Q02928 2/20 0.47
HTT P42858 1/20 0.46
CYP1A2 P05177 1/20 0.46
CPB2 Q96IY4 2/20 0.44
PKM P14618 2/20 0.43
THRB P10828 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
FDPS P14324 2/20 0.40
PAOX Q6QHF9 2/20 0.36
ALOX15 P16050 1/20 0.35
DNM1 Q05193 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 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
SCHEMBL16359211 0.83 CYP4F2 (0.49) CYP4F2CYP4A11HTTCYP1A2CPB2
SCHEMBL8633101 0.81 FDPS (0.42) HTTCYP1A2CPB2THRBMEN1
SCHEMBL15317960 0.79 CYP1A2 (0.47) CYP4F2CYP4A11HTTCYP1A2CPB2
SCHEMBL6389074 0.79 CYP4F2 (0.68) CYP4F2CYP4A11HTTCYP1A2CPB2
SCHEMBL6593255 0.78 CYP4F2 (0.47) CYP4F2CYP4A11HTTCYP1A2CPB2
SCHEMBL8847004 0.76 MEN1 (0.57) CYP4F2CYP4A11HTTPKMTHRB
SCHEMBL8979106 0.75 MEN1 (0.53) CYP4F2CYP4A11HTTCYP1A2CPB2
SCHEMBL29012390 0.74 CYP1A2 (0.42) CYP4F2CYP4A11HTTCYP1A2CPB2
SCHEMBL25169854 0.73 CYP1A2 (0.48) CYP4F2CYP4A11HTTCYP1A2CPB2
SCHEMBL22519815 0.73 CYP4F2 (0.65) CYP4F2CYP4A11HTTCYP1A2CPB2

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