SCHEMBL9006328

SCHEMBL9006328

CCNC(=O)c1ccc(S(=O)(=O)O)c2cccc(C(=O)O)c12

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.40
CA9 Q16790 4/20 0.40
BRD4 O60885 4/20 0.40
AURKA O14965 1/20 0.39
AURKB Q96GD4 1/20 0.39
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
APEX1 P27695 1/20 0.38
CYP1A2 P05177 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ESR1 P03372 1/20 0.37
POLB P06746 1/20 0.37
ESR2 Q92731 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TTR P02766 1/20 0.37
CXCR2 P25025 1/20 0.37
GFER P55789 1/20 0.37
NSD2 O96028 1/20 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
SCHEMBL9006332 0.85 PLK1 (0.45) BRD4AURKAAURKBKMT2AL3MBTL1
SCHEMBL3129169 0.85 AURKA (0.50) AURKAAURKBKMT2AL3MBTL1CYP1A2
SCHEMBL7517756 0.83 AURKA (0.49) AURKAAURKBKMT2AL3MBTL1CYP1A2
SCHEMBL23827186 0.77 AURKA (0.43) AURKAAURKBKMT2AL3MBTL1CYP1A2
SCHEMBL823157 0.77 CYP1A2 (0.56) BRD4KMT2AL3MBTL1APEX1CYP1A2
SCHEMBL13972822 0.74 CA9 (0.49) CA12CA9BRD4KMT2AL3MBTL1
SCHEMBL22283351 0.74 CYP1A2 (0.48) BRD4KMT2AL3MBTL1APEX1CYP1A2
SCHEMBL9006323 0.74 PLK1 (0.44) BRD4AURKAAURKBCYP1A2KDM4E
SCHEMBL7772892 0.72 CA1 (0.46) CA9BRD4AURKAAURKBKMT2A
SCHEMBL16351299 0.71 CYP1A2 (0.44) BRD4KMT2AL3MBTL1APEX1CYP1A2

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
EP-0530036-B1 Base board for printed circuit board MITSUBISHI GAS CHEMICAL CO (JP) 1996-10-16 EP disclosed
US-5314740-A Containing a fluorescent dye in the insulating layer to permit accurate inspection by activation MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1994-05-24 US disclosed
EP-0530036-A1 Base board for printed circuit board MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1993-03-03 EP disclosed