SCHEMBL3205020

SCHEMBL3205020

Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.O=S(=O)([O-])c1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
HPGD P15428 4/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
HSD17B10 Q99714 2/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NR4A1 P22736 1/20 0.35
KDM4E B2RXH2 3/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 2/20 0.33
HKDC1 Q2TB90 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
ACHE P22303 2/20 0.33
CYP1A2 P05177 2/20 0.33
ERBB2 P04626 1/20 0.33
FYN P06241 1/20 0.33
MAOA P21397 1/20 0.33
AHR P35869 1/20 0.33
DUSP5 Q16690 1/20 0.32

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
SCHEMBL450356 0.92 NR4A1 (0.39) ALDH1A1HPGDL3MBTL1HSD17B10CYP3A4
SCHEMBL2903735 0.88 ALDH1A1 (0.36) ALDH1A1HPGDL3MBTL1HSD17B10CYP3A4
SCHEMBL29754167 0.88 NR1I2 (0.37) ALDH1A1HPGDL3MBTL1HSD17B10CYP3A4
SCHEMBL453181 0.88 NR1I2 (0.37) ALDH1A1HPGDL3MBTL1HSD17B10CYP3A4
SCHEMBL2898295 0.87 NR4A1 (0.40) ALDH1A1HPGDL3MBTL1HSD17B10CYP3A4
SCHEMBL3202140 0.86 NR4A1 (0.33) ALDH1A1HPGDL3MBTL1HSD17B10CYP3A4
SCHEMBL3195405 0.86 TDP1 (0.39) ALDH1A1L3MBTL1TDP1NR4A1KDM4E
SCHEMBL3199446 0.86 NR4A1 (0.33) ALDH1A1HPGDL3MBTL1HSD17B10CYP3A4
SCHEMBL2904056 0.85 NR4A1 (0.33) ALDH1A1HPGDNR4A1KDM4EMAPT
SCHEMBL2900933 0.84 PPARG (0.32) ALDH1A1HPGDL3MBTL1HSD17B10CYP3A4

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-8206888-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2012-06-26 US disclosed
US-20100028800-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2010-02-04 US disclosed
US-7060414-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2006-06-13 US disclosed
US-20050158657-A1 Radiation-sensitive resin composition SUZUKI AKI (JP) 2005-07-21 US disclosed
US-6899989-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2005-05-31 US disclosed
US-20020090569-A1 Radiation-sensitive resin composition JSR CORPORATION (JP) 2002-07-11 US disclosed