SCHEMBL3260281

SCHEMBL3260281

O=S(=O)(Nc1c(O)ccc2ccccc12)c1cccc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 2/20 1.00
G6PD P11413 1/20 0.70
HKDC1 Q2TB90 1/20 0.65
HSD17B2 P37059 1/20 0.64
ALDH1A1 P00352 1/20 0.58
HTT P42858 1/20 0.58
PFKFB3 Q16875 1/20 0.54
TSHR P16473 1/20 0.54
EDNRB P24530 2/20 0.50
EDNRA P25101 2/20 0.50
F2 P00734 1/20 0.50
PRSS1 P07477 1/20 0.50
PRSS2 P07478 1/20 0.50
PRSS3 P35030 1/20 0.50
PGR P06401 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
PGAM1 P18669 1/20 0.49
RORA P35398 1/20 0.49

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
SCHEMBL3259256 0.83 G6PD (1.00) HCRTR1G6PDHKDC1HSD17B2ALDH1A1
SCHEMBL829952 0.82 G6PD (0.71) HCRTR1G6PDHKDC1HSD17B2HTT
SCHEMBL5718523 0.80 G6PD (0.69) HCRTR1G6PDHKDC1HSD17B2HTT
SCHEMBL30733446 0.80 G6PD (0.69) HCRTR1G6PDHKDC1HSD17B2HTT
SCHEMBL3258816 0.80 HCRTR1 (0.67) HCRTR1G6PDHKDC1ALDH1A1HTT
SCHEMBL3257769 0.79 HCRTR1 (0.66) HCRTR1ALDH1A1HTTPFKFB3TSHR
SCHEMBL3259564 0.79 G6PD (0.76) HCRTR1G6PDHKDC1HSD17B2ALDH1A1
SCHEMBL3260797 0.79 HKDC1 (1.00) HCRTR1G6PDHKDC1HSD17B2ALDH1A1
SCHEMBL3259317 0.77 ALDH1A1 (0.64) HCRTR1HSD17B2ALDH1A1HTTPFKFB3
SCHEMBL3261087 0.76 TSHR (0.71) HCRTR1ALDH1A1HTTPFKFB3TSHR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2096149-B1 INK FOR SCRATCH COLORING AND SHEET WITH INVISIBLE INFORMATION PRINTED MITSUBISHI PAPER MILLS LTD (JP) 2014-10-22 EP disclosed
US-8283285-B2 Scratch color-developable ink and invisible information printed sheet MITSUBISHI PAPER MILLS LIMITED (JP) 2012-10-09 US disclosed
US-20100021702-A1 SCRATCH COLOR-DEVELOPABLE INK AND INVISIBLE INFORMATION PRINTED SHEET MITSUBISHI PAPER INK MFG. CO., LTD. (JP) 2010-01-28 US disclosed
EP-2096149-A1 INK FOR SCRATCH COLORING AND SHEET WITH INVISIBLE INFORMATION PRINTED Mitsubishi Paper Mills Limited (JP) 2009-09-02 EP disclosed
US-6921740-B1 Electron-receiving compound and thermal recording material MITSUBISHI PAPER MIILS LTD. (JP) 2005-07-26 US disclosed