SCHEMBL3758784

SCHEMBL3758784

CC(C)c1ccc(-c2ccccc2OCc2cccc(COc3ccccc3-c3ccc(C(C)C)cc3)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 7/20 0.48
PTGER4 P35408 4/20 0.48
PTGER3 P43115 4/20 0.48
PTGER2 P43116 4/20 0.48
MRGPRX4 Q96LA9 1/20 0.46
MCL1 Q07820 1/20 0.45
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
SYK P43405 2/20 0.43
ENPP2 Q13822 1/20 0.43
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
DHODH Q02127 2/20 0.42
CFD P00746 1/20 0.41
F11 P03951 1/20 0.41
TPSB2 P20231 1/20 0.41
AURKB Q96GD4 1/20 0.41

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
SCHEMBL10785009 0.91 RXRA (0.52) PTGER1PTGER4PTGER3PTGER2MCL1
SCHEMBL3770937 0.89 RXRA (0.54) PTGER1PTGER4PTGER3PTGER2MCL1
SCHEMBL13739157 0.82 RXRA (0.59) PTGER1PTGER4PTGER3PTGER2MCL1
SCHEMBL25094104 0.81 PTGER1 (0.59) PTGER1PTGER4PTGER3PTGER2MCL1
SCHEMBL10179112 0.78 PTGER1 (0.50) PTGER1PTGER4PTGER3PTGER2MRGPRX4
SCHEMBL12603847 0.78 PTGER1 (0.47) PTGER1PTGER4PTGER3PTGER2MCL1
SCHEMBL8673558 0.77 ADRB2 (0.57) MAPK1TDP1L3MBTL1
SCHEMBL12406129 0.74 PTPRC (0.53) SYKMAPTAURKBINCENP
SCHEMBL201074 0.73 RXRA (0.70) PTGER1PTGER4PTGER3PTGER2MCL1
SCHEMBL3786776 0.73 MAPT (0.58) PTGER1PTGER4PTGER3PTGER2MCL1

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
US-8978553-B2 Heat-sensitive lithographic printing plates MITSUBISHI PAPER MILLS LIMITED (JP) 2015-03-17 US disclosed
US-20120192740-A1 FOUNTAIN SOLUTION COMPOSITION FOR LITHOGRAPHIC PRINTING PLATE AND LITHOGRAPHIC PRINTING METHOD MITSUBISHI PAPER MILLS LIMITED (JP) 2012-08-02 US disclosed
US-20100307359-A1 HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATES MITSUBISHI PAPER MILLS LIMITED (JP) 2010-12-09 US disclosed