SCHEMBL29001030

SCHEMBL29001030

O=C(O)c1cc2c(C(=O)O)c(C(=O)O)c(C(=O)O)c(C(=O)O)c2cc1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.40
CDC25A P30304 1/20 0.40
CDC25B P30305 1/20 0.40
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.39
CYP1A2 P05177 2/20 0.39
HPGD P15428 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
GLA P06280 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALOX15 P16050 1/20 0.39
LDHA P00338 2/20 0.39
LDHB P07195 2/20 0.39
GPR35 Q9HC97 1/20 0.36
CA12 O43570 3/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA7 P43166 3/20 0.36
CA9 Q16790 3/20 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
SCHEMBL1375497 0.85 KDM4E (0.44) HSD17B10ALDH1A1KDM4ECYP1A2HPGD
Mellitic Acid SCHEMBL4394065 0.85 ALDH1A1 (0.45) HSD17B10CDC25ACDC25BALDH1A1KDM4E
SCHEMBL3872491 0.82 ALDH1A1 (0.47) HSD17B10CDC25ACDC25BALDH1A1KDM4E
SCHEMBL11177876 0.82 HSD17B10 (0.50) HSD17B10CDC25ACDC25BALDH1A1KDM4E
SCHEMBL471893 0.80 CYP1A2 (0.39) HSD17B10CDC25ACDC25BALDH1A1KDM4E
SCHEMBL31401814 0.80 KDM4E (0.39) HSD17B10CDC25ACDC25BALDH1A1KDM4E
SCHEMBL30879499 0.80 CYP1A2 (0.39) HSD17B10CDC25ACDC25BALDH1A1KDM4E
SCHEMBL11928183 0.77 CYP1A2 (0.46) HSD17B10CDC25ACDC25BALDH1A1KDM4E
SCHEMBL29771739 0.77 HSD17B10 (0.36) HSD17B10CDC25ACDC25BALDH1A1KDM4E
SCHEMBL29115233 0.77 LDHA (0.48) HSD17B10CDC25ACDC25BALDH1A1KDM4E

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
CN-115954444-B Preparation method of naphthalene polycarboxylate organic material and application of naphthalene polycarboxylate organic material in metal ion battery 中国科学院深圳先进技术研究院 2025-01-14 CN claimed
CN-115954444-A Preparation method of naphthyl polycarboxylate organic material and application of naphthyl polycarboxylate organic material in metal ion battery 中国科学院深圳先进技术研究院 2023-04-11 CN claimed
CN-115954444-B Preparation method of naphthalene polycarboxylate organic material and application of naphthalene polycarboxylate organic material in metal ion battery 中国科学院深圳先进技术研究院 2025-01-14 CN disclosed