SCHEMBL19182829

SCHEMBL19182829

CCc1cc(OC(=O)O)oc1OC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GLA P06280 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HTT P42858 2/20 0.33
HSD17B10 Q99714 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
DAO P14920 1/20 0.32
HPGD P15428 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
SCHEMBL19183293 0.71 POLB (0.30) POLBTDP1L3MBTL1
SCHEMBL19712582 0.70
SCHEMBL6968831 0.69 KMT2A (0.41) POLBTDP1L3MBTL1ALDH1A1HTT
SCHEMBL377105 0.69 ALOX15 (0.39)
SCHEMBL4447965 0.67 HIF1A (0.39) POLBKDM4EALDH1A1HSD17B10MAPT
SCHEMBL17200005 0.67 EPHX2 (0.36) TDP1L3MBTL1KDM4EALDH1A1TP53
SCHEMBL19712583 0.65 NPC1 (0.41) L3MBTL1KDM4EALDH1A1HSD17B10LMNA
SCHEMBL377017 0.65 KMT2A (0.32) TDP1ALDH1A1TP53
SCHEMBL9574620 0.64 GPR35 (0.32) TDP1KDM4E
SCHEMBL21757375 0.64 SMN1; SMN2 (0.40) POLBHSD17B10

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
EP-3408308-A1 METHOD FOR PRODUCING FURAN-BASED POLYESTER BASF SE (DE) 2018-12-05 EP disclosed
WO-2017129584-A1 METHOD FOR PRODUCING FURAN-BASED POLYESTER BASF SE (DE) 2017-08-03 WO disclosed