SCHEMBL2944393

SCHEMBL2944393

CC(=O)c1c(O)c(O)cc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 3/20 0.50
KDM4E B2RXH2 2/20 0.50
CYP2C19 P33261 2/20 0.50
CYP1A2 P05177 1/20 0.50
GLA P06280 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MAPT P10636 4/20 0.49
POLB P06746 2/20 0.49
NSD2 O96028 1/20 0.49
MCL1 Q07820 1/20 0.49
TRPM4 Q8TD43 1/20 0.48
THRB P10828 1/20 0.45
CYP2C9 P11712 1/20 0.45
GAA P10253 1/20 0.44
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
BCL2L1 Q07817 1/20 0.43

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
SCHEMBL2941699 0.85 MAPT (0.49) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL88986 0.83 CYP1A2 (0.68) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL29779946 0.83 CYP1A2 (0.68) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL67303 0.82 ALDH1A1 (0.65) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL29491183 0.82 ALDH1A1 (0.65) MEN1KMT2AALDH1A1HPGDKDM4E
Hydrochloric Acid SCHEMBL11313207 0.81 CYP1A2 (0.66) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL10351077 0.81 CYP1A2 (0.50) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL1520762 0.81 MEN1 (0.54) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL11484901 0.80 BCL2L1 (0.56) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL10670561 0.77 KDM4E (0.42) MEN1KMT2AALDH1A1HPGDKDM4E

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
CN-103980245-B Compound for inhibiting glutathione S-transferase omega1 activity, preparation method thereof and pharmaceutical composition containing compound CHINA MEDICAL UNIVERSITY (CN) 2016-02-03 CN disclosed
EP-1476786-B1 PHOTOSENSITIVE COMPOSITION, PHOTOSENSITIVE PLANOGRAPHIC PRINTING PLATE, AND METHOD FOR MANUFACTURING PLANOGRAPHIC PRINTING PLATE USING THE SAME KODAK GRAPHIC COMM JAPAN LTD (JP) 2010-01-06 EP disclosed
US-6824947-B2 FORMED FROM A PHENOL AND DIMETHYLOLUREA; PLANOGRAPHIC PRINTING PLATE PRECURSORS TO FORM PLATES THAT EXHIBIT GOOD DURABILITY, GOOD EXPOSURE VISUAL IMAGE PROPERTY, AND GOOD SOLVENT RESISTANCE ESPECIALLY TO WASHING OIL USED IN UV INK KODAK POLYCHROME GRAPHICS, LLC 2004-11-30 US disclosed
EP-1476786-A2 PHOTOSENSITIVE COMPOSITION, PHOTOSENSITIVE PLANOGRAPHIC PRINTING PLATE, AND METHOD FOR MANUFACTURING PLANOGRAPHIC PRINTING PLATE USING THE SAME Kodak Polychrome Graphics Japan Ltd. (JP) 2004-11-17 EP disclosed
US-20030224281-A1 Photosensitive composition comprising a phenol resin having a urea bond in the main chain BANK OF AMERICA, N.A., AS AGENT 2003-12-04 US disclosed
WO-2003071355-A2 PHOTOSENSITIVE COMPOSITION, PHOTOSENSITIVE PLANOGRAPHIC PRINTING PLATE, AND METHOD FOR MANUFACTURING PLANOGRAPHIC PRINTING PLATE USING THE SAME KODAK POLYCHROME GRAPHICS JAPAN LTD. (JP) 2003-08-28 WO disclosed