SCHEMBL6521772

SCHEMBL6521772

CCOCCC(C(=O)O)n1c(=O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.36
TSHR P16473 2/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
POLB P06746 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PDE3B Q13370 1/20 0.30
PDE3A Q14432 1/20 0.30
P2RY12 Q9H244 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL6518031 0.88 HSD17B10 (0.32) HSD17B10TSHRCASP1CASP7HPGD
SCHEMBL6524657 0.84 SMN1; SMN2 (0.36) HSD17B10TSHRCASP1CASP7SMN1; SMN2
SCHEMBL6516677 0.84 HCAR2 (0.33) HSD17B10HPGDKMT2AALDH1A1
SCHEMBL6525454 0.82 ALDH1A1 (0.34) HSD17B10TSHRSMN1; SMN2MEN1KMT2A
SCHEMBL6525042 0.79 POLB (0.40) HSD17B10SMN1; SMN2HPGDMEN1KMT2A
SCHEMBL6521626 0.78 CYP1A2 (0.32) HSD17B10HPGDALDH1A1
SCHEMBL6518036 0.72 APEX1 (0.32)
SCHEMBL6516987 0.71 PKM (0.34) SMN1; SMN2
SCHEMBL6522896 0.71 PKM (0.32)
SCHEMBL5718373 0.67 MAPT (0.41)

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-6841305-B2 High temperature, storage stability MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2005-01-11 US disclosed
US-20020009652-A1 High temperature, storage stability MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2002-01-24 US disclosed
EP-1160899-A2 Non-aqueous electrolyte battery and non-aqueous electrolyte MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2001-12-05 EP disclosed