SCHEMBL6829025

SCHEMBL6829025

O=C(O)c1cccc2ccc3c4ccccc4cc(C(=O)O)c3c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.53
NR4A2 P43354 1/20 0.53
NR4A3 Q92570 1/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
RXFP1 Q9HBX9 1/20 0.53
SOS1 Q07889 2/20 0.52
HSD17B10 Q99714 2/20 0.51
CYP1A2 P05177 2/20 0.51
ERBB2 P04626 1/20 0.51
FYN P06241 1/20 0.51
MAOA P21397 1/20 0.51
ACHE P22303 1/20 0.51
AHR P35869 1/20 0.51
PTPN1 P18031 1/20 0.50
CDC25B P30305 2/20 0.47
GPR35 Q9HC97 2/20 0.46
POLB P06746 1/20 0.46
GRIN2D O15399 1/20 0.46
GRIN2A Q12879 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
Hydrochloric Acid SCHEMBL4607669 0.98 NR4A1 (0.51) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL28356334 0.90 NR4A1 (0.60) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL12486124 0.85 MEN1 (0.57) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL12486214 0.85 NR4A1 (0.63) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL4607665 0.83 CYP1A2 (0.50) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL2834703 0.80 HSD17B10 (0.75) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL9041814 0.79 NR4A1 (0.51) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL2157267 0.79 NR4A1 (0.70) NR4A1NR4A2NR4A3MEN1KMT2A
SCHEMBL11879206 0.79 MEN1 (0.55) NR4A1NR4A2NR4A3MEN1KMT2A
Ammonia Solution, Strong SCHEMBL31590375 0.78 HSD17B10 (0.72) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230123889-A1 METHOD FOR DEGRADING BENZO(A)PYRENE WITH A HALOPHILIC BACTERIUM STRAIN OF STAPHYLOCOCCUS HAEMOLITICUS KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2023-04-20 US disclosed
US-9790484-B2 Silica encapsulated biomaterials REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2017-10-17 US disclosed
US-20140051144-A1 SILICA ENCAPSULATED BIOMATERIALS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2014-02-20 US disclosed
WO-2012116013-A2 SILICA ENCAPSULATED BIOMATERIALS WACKETT LAWRENCE P (US) 2012-08-30 WO disclosed
US-20040023362-A1 Degradation of polycyclic aromatic hydrocarbons by microorganisms STANLEY GRANT (AU) 2004-02-05 US disclosed
WO-2001064841-A1 DEGRADATION OF POLYCYCLIC AROMATIC HYDROCARBONS BY MICROORGANISMS VICTORIA UNIVERSITY OF TECHNOLOGY (AU) 2001-09-07 WO disclosed