SCHEMBL8633676

SCHEMBL8633676

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.37
DGAT1 O75907 1/20 0.35
LMNA P02545 2/20 0.35
USP2 O75604 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
HDAC8 Q9BY41 1/20 0.33
TSHR P16473 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
GAA P10253 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
PABPC1 P11940 1/20 0.30
APOBEC3A P31941 1/20 0.30
APOBEC3G Q9HC16 1/20 0.30
RECQL P46063 2/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL8632724 0.88 DGAT1 (0.39) DGAT1HDAC8MEN1KMT2AGAA
SCHEMBL8632463 0.86 CYP1A2 (0.35) EPHX2LMNAUSP2HDAC8TSHR
SCHEMBL8633728 0.81 DGAT1 (0.36) DGAT1MEN1KMT2AGAA
SCHEMBL8630685 0.79 DGAT1 (0.41) DGAT1HDAC8HDAC1HDAC2HDAC6
SCHEMBL2331646 0.78 EPHX2 (0.40) EPHX2LMNAL3MBTL1HDAC8MEN1
SCHEMBL2336876 0.78 EPHX2 (0.40) EPHX2LMNAL3MBTL1HDAC8MEN1
SCHEMBL2332922 0.78 EPHX2 (0.40) EPHX2LMNAL3MBTL1HDAC8MEN1
SCHEMBL18306201 0.78 EPHX2 (0.39) EPHX2LMNAUSP2L3MBTL1HDAC8
SCHEMBL27686173 0.78 EPHX2 (0.39) EPHX2LMNAUSP2L3MBTL1HDAC8
SCHEMBL4230480 0.77 EPHX2 (0.40) EPHX2LMNAL3MBTL1HDAC8MEN1

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 3 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
WO-1994010127-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE' FARMACEUTICI S.P.A. (IT) 1994-05-11 WO disclosed