SCHEMBL8633560

SCHEMBL8633560

CCOC(=O)C(CCc1cccnc1)(OC(=O)c1ccccc1)C(=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
LMNA P02545 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.44
MAPK1 P28482 1/20 0.44
CHRNA7 P36544 1/20 0.44
ALDH1A1 P00352 3/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
TBXAS1 P24557 3/20 0.43
TP53 P04637 1/20 0.42
FDPS P14324 1/20 0.41
NAMPT P43490 1/20 0.41
MAPT P10636 1/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL8634964 0.87 NAMPT (0.46) KMT2ALMNASMN1; SMN2ALDH1A1POLB
SCHEMBL8629786 0.79 KDM4E (0.45) KMT2ALMNASMN1; SMN2ALDH1A1GAA
SCHEMBL8634426 0.78 FDPS (0.52) KMT2ATDP1SMN1; SMN2MAPK1CHRNA7
SCHEMBL8631399 0.74 LMNA (0.45) KMT2ALMNATDP1SMN1; SMN2MAPK1
SCHEMBL30335358 0.73 LMNA (0.52) KMT2ALMNATDP1SMN1; SMN2ALDH1A1
SCHEMBL5861404 0.73 ALDH1A1 (0.50) KMT2ALMNATDP1SMN1; SMN2MAPK1
SCHEMBL8636980 0.72 LMNA (0.43) KMT2ALMNATDP1SMN1; SMN2MAPK1
SCHEMBL7057410 0.71 ALDH1A1 (0.48) KMT2ALMNATDP1SMN1; SMN2MAPK1
SCHEMBL5860273 0.71 CYP1A2 (0.54) KMT2ALMNATDP1SMN1; SMN2MAPK1
SCHEMBL27564027 0.71 CYP1A2 (0.57) KMT2ALMNATDP1SMN1; SMN2MAPK1

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 4 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
WO-1994010127-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE' FARMACEUTICI S.P.A. (IT) 1994-05-11 WO disclosed