SCHEMBL2168174

SCHEMBL2168174

O=S(=O)(O)c1cccc2ccc[c]c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.39
FABP4 P15090 1/20 0.39
CCNA2 P20248 1/20 0.39
CDK2 P24941 1/20 0.39
MAPK14 Q16539 1/20 0.39
NR4A1 P22736 1/20 0.38
TSHR P16473 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
MYC P01106 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ATIC P31939 1/20 0.32
F2 P00734 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 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
SCHEMBL6630465 0.81 CTRB1 (0.35) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL4898718 0.79 TSHR (0.39) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1
SCHEMBL6631749 0.77 TTR (0.43) TTRTSHRSMN1; SMN2MYCALDH1A1
SCHEMBL1413194 0.77 TTR (0.39) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL11208662 0.77 TTR (0.36) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL6598756 0.76 TTR (0.50) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL6597055 0.75 TSHR (0.41) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL6634238 0.74 TTR (0.37) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL6632348 0.74 TTR (0.37) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL176809 0.74 TTR (0.38) TTRFABP4CCNA2CDK2MAPK14

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 102 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0712841-B1 Process for the preparation of 3(N-aryl-amino)-propyl-2'-sulfatoethylsulfonyl compounds DYSTAR TEXTILFARBEN GMBH & CO (DE) 1999-01-13 EP claimed
US-5811081-A Use of hydroxybenzotriazoles for enhancing the sun protection factor of cellulosic fibre materials CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-09-22 US claimed
US-5777111-A DERIVATIVES OF ARYL SUBSTITUTED 1,3-OXAZINES HOECHST AKTIENGESELLSCHAFT (DE) 1998-07-07 US claimed
US-5672738-A REACTING AN AROMATIC SUBSTITUTED CYCLIC CARBAMATE WITH 2-MERCAPTETHANOL IN PRESENCE OF A BASIC CATALYST HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-30 US claimed
EP-0712841-A1 Process for the preparation of 3(N-aryl-amino)-propyl-2'-sulfatoethylsulfonyl compounds HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-22 EP claimed
EP-0708197-A2 Utilisation of hydroxybenztriazoles for increasing the sun-ray filter index of fibrous cellulosic materials CIBA-GEIGY AG (CH) 1996-04-24 EP claimed
EP-0050266-B1 REACTIVE DISAZO DYES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN DYEING AND PRINTING MATERIALS THAT CONTAIN HYDROXYL AND/OR NITROGEN BAYER AG (DE) 1984-10-03 EP claimed
EP-2243805-B1 ANTHRAPYRIDONE COMPOUND OR SALT THEREOF, MAGENTA INK COMPOSITION CONTAINING THE ANTHRAPYRIDONE COMPOUND, AND COLORED BODY NIPPON KAYAKU KK (JP) 2014-11-26 EP disclosed
US-7985287-B2 Anthrapyridone compound or a salt thereof, magenta ink composition containing the anthrapyridone compound and colored product NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-07-26 US disclosed
US-20100291360-A1 Anthrapyridone Compound Or A Salt Thereof, Magenta Ink Composition Containing The Anthrapyridone Compound and Colored Product NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-11-18 US disclosed
EP-2243805-A1 ANTHRAPYRIDONE COMPOUND OR SALT THEREOF, MAGENTA INK COMPOSITION CONTAINING THE ANTHRAPYRIDONE COMPOUND, AND COLORED BODY Nippon Kayaku Kabushiki Kaisha (JP) 2010-10-27 EP disclosed
US-7122299-B2 Silver halide photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 2006-10-17 US disclosed
US-6841115-B2 Mold release agent and process for the production of plastic molded parts BAYER AKTIENGESELLSCHAFT (DE) 2005-01-11 US disclosed
EP-0318968-A2 Monoazo red dye compound having vinylsulfone type fiber reactive groups SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-06-07 EP disclosed
EP-0276686-A2 Anthraquinone compound and dyeing or printing method using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-08-03 EP disclosed
US-4670548-A Sulfo-group-containing trisazo dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1987-06-02 US disclosed
US-4638055-A LEATHER, COBALT COMPLEXES BASF AKTIENGESELLSCHAFT (DE) 1987-01-20 US disclosed
EP-0091020-B1 DISAZO DYESTUFFS BASF Aktiengesellschaft (DE) 1986-03-05 EP disclosed
US-4547566-A Copper, cobalt, nickel and iron complexes of disazo dyes BASF AKTIENGESELLSCHAFT (DE) 1985-10-15 US disclosed
EP-0091020-A1 Disazo dyestuffs BASF Aktiengesellschaft (DE) 1983-10-12 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100291360-A1 Anthrapyridone Compound Or A Salt Thereof, Magenta Ink Composition Containing The Anthrapyridone Compound and Colored Product MLLT3, MLLT1, H1-3 TTR 3675/4885FABP4 3652/4885CCNA2 946/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.