SCHEMBL8079639

SCHEMBL8079639

CC(=O)OCC(O)C(O)COC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 9/20 0.48
LMNA P02545 2/20 0.48
HSD17B10 Q99714 1/20 0.48
USP2 O75604 3/20 0.40
CYP3A4 P08684 3/20 0.40
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
RECQL P46063 1/20 0.40
HPGD P15428 1/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 4/20 0.39
CHRM5 P08912 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.39
PGR P06401 1/20 0.39
CHRM2 P08172 1/20 0.39

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
SCHEMBL14130601 1.00 TDP1 (0.48) TDP1ALDH1A1LMNAHSD17B10USP2
SCHEMBL8816454 0.90 ALDH1A1 (0.46) TDP1ALDH1A1LMNAHSD17B10USP2
SCHEMBL13737428 0.90 TDP1 (0.42) TDP1ALDH1A1LMNAHSD17B10USP2
Ammonia Solution, Strong SCHEMBL9691236 0.88 ALDH1A1 (0.44) TDP1ALDH1A1LMNAHSD17B10USP2
SCHEMBL2409417 0.87 TDP1 (0.43) TDP1ALDH1A1LMNAHSD17B10USP2
SCHEMBL14508563 0.87 TDP1 (0.43) TDP1ALDH1A1LMNAHSD17B10USP2
SCHEMBL13623332 0.85 TDP1 (0.42) TDP1ALDH1A1LMNAHSD17B10USP2
SCHEMBL12019789 0.83 TDP1 (0.41) TDP1ALDH1A1LMNAHSD17B10USP2
SCHEMBL304203 0.82 TDP1 (0.54) TDP1ALDH1A1LMNAHSD17B10USP2
SCHEMBL18880920 0.81 LMNA (0.42) TDP1ALDH1A1LMNAHSD17B10USP2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009030733-A1 METHOD FOR THE SYNTHESIS OF 4-ALKOXY-, 4-HYDROXY- AND 4-ARYLOXY-SUBSTITUTED TETRAHYDRO-FURO[3,4-B]FURAN-2(3H)-ONE COMPOUNDS DSM IP ASSETS B.V. (NL) 2009-03-12 WO disclosed
WO-2008034598-A1 METHOD FOR THE SYNTHESIS OF HEXAHYDROFURO (2, 3-B) FURAN-3-OL COMPOUNDS DSM IP ASSETS B.V. (NL) 2008-03-27 WO disclosed