SCHEMBL6525463

SCHEMBL6525463

CCC(C(=O)O)n1c(=O)n(C(CC)C(=O)O)c(=O)n(C(CC)C(=O)O)c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
CA2 P00918 2/20 0.40
LMNA P02545 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA3 P07451 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA13 Q8N1Q1 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
KDM4E B2RXH2 3/20 0.36
MAPT P10636 3/20 0.36
HSD17B10 Q99714 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL7344992 0.80 POLB (0.41) POLBCA2LMNACA12CA1
SCHEMBL6525042 0.77 POLB (0.40) POLBCA2LMNACA12CA1
SCHEMBL6516885 0.77 ALDH1A1 (0.34) POLBKDM4EMAPTHSD17B10TDP1
SCHEMBL698898 0.76 ALDH1A1 (0.56) POLBCA2LMNACA12CA1
SCHEMBL29251519 0.76 POLB (0.36) POLBKDM4ETDP1MEN1KMT2A
SCHEMBL2813031 0.73 ALDH1A1 (0.53) CA2LMNACA12CA1CA3
SCHEMBL17371773 0.72 POLB (0.42) POLBKDM4EMAPTHSD17B10TDP1
Ethylene Glycol SCHEMBL5092855 0.71 ALDH1A1 (0.51) POLBCA2LMNACA12CA1
SCHEMBL964946 0.71 DNMT1 (0.44) POLBLMNAKDM4EMAPTHSD17B10
SCHEMBL6937699 0.71 ALDH1A1 (0.40) POLBKDM4EMAPTHSD17B10MEN1

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