SCHEMBL6850396

SCHEMBL6850396

CCOC(=O)c1cccc(S(=O)(=O)O)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
HSD17B10 Q99714 2/20 0.49
ALDH1A1 P00352 1/20 0.49
CA12 O43570 3/20 0.49
CA1 P00915 3/20 0.49
CA2 P00918 3/20 0.49
CA7 P43166 3/20 0.49
CA9 Q16790 3/20 0.49
CA14 Q9ULX7 3/20 0.49
GAA P10253 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 3/20 0.46
CLEC4M Q9H2X3 1/20 0.46
CDC25B P30305 3/20 0.46
LMNA P02545 1/20 0.44
CYP1A2 P05177 2/20 0.44
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
CDC25A P30304 1/20 0.43
CDC25C P30307 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
SCHEMBL6525942 0.85 TSHR (0.67) TSHRHSD17B10ALDH1A1CA1CA2
Ammonia Solution, Strong SCHEMBL6048340 0.84 TSHR (0.65) TSHRHSD17B10ALDH1A1CA1CA2
Ammonia Solution, Strong SCHEMBL6048341 0.84 TSHR (0.65) TSHRHSD17B10ALDH1A1CA1CA2
SCHEMBL5013285 0.84 TSHR (0.65) TSHRHSD17B10ALDH1A1CA1CA2
SCHEMBL10571657 0.83 TSHR (0.73) TSHRHSD17B10ALDH1A1CA12CA1
SCHEMBL11522628 0.82 TSHR (0.53) TSHRHSD17B10ALDH1A1CA12CA1
SCHEMBL19405553 0.79 CA1 (0.37) TSHRHSD17B10ALDH1A1CA1CA2
SCHEMBL1242911 0.78 GAA (0.66) TSHRHSD17B10ALDH1A1CA12CA1
SCHEMBL340364 0.78 CA12 (0.67) TSHRHSD17B10ALDH1A1CA12CA1
SCHEMBL28364184 0.78 CA12 (0.72) TSHRALDH1A1CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107206827-B Lithographic printing plate precursor, method for producing same, and printing method using same 富士胶片株式会社 2020-01-21 CN disclosed
US-6734225-B2 DISPERSION OF OIL-SOLUBLE DYE PARTICLES BASED ON A PYRAZOLO-(5,1-C)-S-TRIAZOLE OR PYRAZOLO(1,5-B) RING; STABILITY; COLORFASTNESS; WATERPROOFING; REPRODUCTION, ESPECIALLY MAGENTA; PRINTING ON PAPER; ANTIFOULING AGENTS FUJI PHOTO FILM CO., LTD. (JP) 2004-05-11 US disclosed
US-20010020056-A1 Coloring composition, ink for ink jet, and ink jet recording method FUJIFILM CORPORATION (JP) 2001-09-06 US disclosed
CN-1268116-A 3-amidinoaniline derivatives activated blood coagulation factor X inhibitors, and intermediates for producing both KISSEI PHARMACEUTICAL (JP) 2000-09-27 CN disclosed