SCHEMBL7212846

SCHEMBL7212846

COC(=O)c1ccccc1OC(=O)Oc1cccc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.56
GAA P10253 3/20 0.56
ALDH1A1 P00352 3/20 0.56
PGR P06401 1/20 0.56
PTGS1 P23219 1/20 0.56
MAPK1 P28482 1/20 0.56
SLC6A3 Q01959 1/20 0.56
KDM4E B2RXH2 4/20 0.51
HPGD P15428 2/20 0.51
KMT2A Q03164 6/20 0.50
HTT P42858 2/20 0.50
POLB P06746 1/20 0.50
ATM Q13315 1/20 0.50
ESR1 P03372 1/20 0.50
ESR2 Q92731 1/20 0.50
MAPT P10636 4/20 0.49
MAPK8 P45983 1/20 0.48
MAPK9 P45984 1/20 0.48
MAPK10 P53779 1/20 0.48
MEN1 O00255 2/20 0.48

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
SCHEMBL5706127 0.90 SLC6A3 (0.52) HSD17B10GAAALDH1A1PGRPTGS1
SCHEMBL29163789 0.88 KMT2A (0.60) HSD17B10GAAALDH1A1PGRPTGS1
SCHEMBL29551673 0.87 SLC6A3 (0.71) HSD17B10GAAALDH1A1MAPK1SLC6A3
SCHEMBL47893 0.87 SLC6A3 (0.71) HSD17B10GAAALDH1A1MAPK1SLC6A3
SCHEMBL7211208 0.85 SLC6A3 (0.50) HSD17B10GAAALDH1A1PGRPTGS1
SCHEMBL5706132 0.84 SLC6A3 (0.50) HSD17B10GAAALDH1A1MAPK1SLC6A3
SCHEMBL29525161 0.84 HSD17B10 (0.67) HSD17B10GAAALDH1A1PGRPTGS1
SCHEMBL5706157 0.84 SLC6A3 (0.72) HSD17B10GAAALDH1A1MAPK1SLC6A3
SCHEMBL1598809 0.84 HSD17B10 (0.67) HSD17B10GAAALDH1A1PGRPTGS1
SCHEMBL29901836 0.83 ALDH1A1 (0.65) HSD17B10GAAALDH1A1PGRPTGS1

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
EP-1114841-B1 PROCESS FOR PRODUCING POLYARYLATE TEIJIN LTD (JP) 2003-10-08 EP disclosed
US-6417291-B1 CONDENSATION POLYMERIZATION AND ESTERIFICATION OF AROMATIC DIOL AND ESTER-FORMING MONOMER; ENDCAPPING WITH SALICYLIC ACID ESTER DERIVATIVE TEIJIN LIMITED (JP) 2002-07-09 US disclosed
EP-1114841-A1 PROCESS FOR PRODUCING POLYARYLATE TEIJIN LIMITED (JP) 2001-07-11 EP disclosed