SCHEMBL31401764

SCHEMBL31401764

O=C(O)c1cc(C(=O)O)c2ccccc2c1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.57
HSD17B10 Q99714 3/20 0.57
CYP2C9 P11712 1/20 0.57
TSHR P16473 1/20 0.57
ALOX12 P18054 1/20 0.57
ATIC P31939 1/20 0.57
KDM4E B2RXH2 5/20 0.52
ALDH1A1 P00352 3/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
CYP1A2 P05177 1/20 0.52
GLA P06280 1/20 0.52
CYP2C19 P33261 1/20 0.52
ALOX15 P16050 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47
THRB P10828 1/20 0.47
NR4A1 P22736 1/20 0.47
NR4A2 P43354 1/20 0.47
NR4A3 Q92570 1/20 0.47
PRNP P04156 1/20 0.46

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
SCHEMBL29417867 1.00 HPGD (0.57) HPGDHSD17B10CYP2C9TSHRALOX12
SCHEMBL29511 1.00 HPGD (0.57) HPGDHSD17B10CYP2C9TSHRALOX12
SCHEMBL7850627 0.88 HPGD (0.50) HPGDHSD17B10CYP2C9TSHRALOX12
SCHEMBL2694305 0.84 HPGD (0.50) HPGDHSD17B10CYP2C9TSHRALOX12
SCHEMBL4781541 0.83 THRB (0.69) HPGDHSD17B10CYP2C9TSHRALOX12
SCHEMBL27571871 0.83 THRB (0.58) HPGDHSD17B10CYP2C9TSHRALOX12
Hydrochloric Acid SCHEMBL9401926 0.83 HPGD (0.49) HPGDHSD17B10CYP2C9TSHRALOX12
SCHEMBL16553078 0.82 PTPN1 (0.54) HPGDHSD17B10CYP2C9TSHRALOX12
SCHEMBL9996096 0.82 PRNP (0.54) HPGDHSD17B10CYP2C9TSHRALOX12
SCHEMBL1129298 0.82 ALDH1A1 (0.50) HPGDHSD17B10CYP2C9TSHRALOX12

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 1 patent. 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 disclosed