SCHEMBL28356334

SCHEMBL28356334

O=C(O)c1cccc2c1c(C(=O)O)cc1ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.60
NR4A2 P43354 1/20 0.60
NR4A3 Q92570 1/20 0.60
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
RXFP1 Q9HBX9 1/20 0.54
HSD17B10 Q99714 3/20 0.53
CDC25B P30305 3/20 0.53
GPR35 Q9HC97 2/20 0.51
GRIN2D O15399 1/20 0.51
GRIN2A Q12879 1/20 0.51
GRIN2B Q13224 1/20 0.51
GRIN2C Q14957 1/20 0.51
PTPN1 P18031 1/20 0.51
POLB P06746 1/20 0.51
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.50
HPGD P15428 2/20 0.50
SOS1 Q07889 1/20 0.50
CYP1A2 P05177 1/20 0.50

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
SCHEMBL6829025 0.90 NR4A1 (0.53) NR4A1NR4A2NR4A3MEN1KMT2A
Hydrochloric Acid SCHEMBL4607669 0.89 NR4A1 (0.51) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL9041814 0.89 NR4A1 (0.51) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL12486124 0.84 MEN1 (0.57) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL9217742 0.82 NR4A1 (0.43) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL9215183 0.82 ALDH1A1 (0.46) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL9218777 0.81 IDO1 (0.51) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL11879206 0.81 MEN1 (0.55) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL522958 0.80 MEN1 (0.71) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL12486214 0.80 NR4A1 (0.63) NR4A1NR4A2NR4A3MEN1KMT2A

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
CN-110465299-A Pyrogenic metal complex prepares nickel-base catalyst UNIV TIANJIN TECHNOLOGY 2019-11-19 CN claimed
CN-115490899-B Proton exchange membrane 中国科学院福建物质结构研究所 2024-02-23 CN disclosed