SCHEMBL1363982

SCHEMBL1363982

Nc1cccc(S(=O)(=O)O)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.41
NOS2 P35228 1/20 0.41
TSHR P16473 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CASR P41180 1/20 0.40
KDM4E B2RXH2 2/20 0.39
TTR P02766 1/20 0.38
ASIC3 Q9UHC3 1/20 0.38
NT5E P21589 1/20 0.37
XIAP P98170 1/20 0.36
BIRC2 Q13490 1/20 0.36
PLAU P00749 1/20 0.35
NCF1 P14598 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
GRM4 Q14833 1/20 0.33
AURKA O14965 1/20 0.33
AURKB Q96GD4 1/20 0.33
HSD11B1 P28845 1/20 0.33

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
SCHEMBL31544789 1.00 NOS3 (0.41) NOS3NOS2TSHRALDH1A1HSD17B10
SCHEMBL8847325 0.84 TSHR (0.42) TSHRALDH1A1HSD17B10TDP1CASR
Sulfuric Acid SCHEMBL2243571 0.81 NOS2 (0.48) NOS3NOS2TSHRALDH1A1HSD17B10
SCHEMBL17647899 0.80 NOS3 (0.43) NOS3NOS2TSHRTDP1ASIC3
SCHEMBL30253319 0.78 NOS3 (0.46) NOS3NOS2ALDH1A1KDM4EASIC3
Ammonia Solution, Strong SCHEMBL28206444 0.78 NOS3 (0.41) NOS3NOS2TSHRTDP1ASIC3
SCHEMBL9179403 0.78 TSHR (0.43) TSHRALDH1A1CASRSMN1; SMN2
SCHEMBL9176772 0.77 TSHR (0.42) TSHRALDH1A1CASRSMN1; SMN2
SCHEMBL9174597 0.77 TSHR (0.42) TSHRALDH1A1CASRSMN1; SMN2
SCHEMBL9176169 0.77 TSHR (0.42) TSHRALDH1A1CASRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12036208-B2 Methods for treating neurodegenerative disorders ALZHEON, INC. (US) 2024-07-16 US disclosed
US-12036208-B2 Methods for treating neurodegenerative disorders ALZHEON, INC. (US) 2024-07-16 US disclosed
US-RE49569-E1 Alkylamine derivative EA PHARMA CO., LTD. (JP) 2023-07-04 US disclosed
US-11077095-B2 Methods for treating neurodegenerative disorders ALZHEON, INC. (US) 2021-08-03 US disclosed
CN-108950645-B Aluminum and aluminum alloy anodic oxidation nickel-free sealing agent 上海铝通化学科技有限公司 2020-10-23 CN disclosed
CN-108950645-A A kind of aluminium and aluminium alloy anode oxide are without nickel sealer 上海铝通化学科技有限公司 2018-12-07 CN disclosed
EP-2546231-B1 ALKYLAMINE DERIVATIVE EA PHARMA CO LTD (JP) 2018-11-07 EP disclosed
US-9561216-B2 Alkylamine derivative EA PHARMA CO., LTD. (JP) 2017-02-07 US disclosed
US-20160101091-A1 ALKYLAMINE DERIVATIVE AJINOMOTO CO., INC. (JP) 2016-04-14 US disclosed
US-9253997-B2 Alkylamine derivative AJINOMOTO CO., INC. (JP) 2016-02-09 US disclosed
CN-1802610-A Polyhydroxyalkanoate containing amide group, sulfonic acid group and sulfonate group, method for producing the same, and charge control agent, toner, image forming method and image forming apparatus CANON KK (JP) 2006-07-12 CN disclosed
US-20060014921-A1 Polyhydroxyalkanoate containing amide group, sulfonic group, and sulfonate ester group, method for producing the same, and charge control agent, toner, image forming method, and image forming apparatus CANON KABUSHIKI KAISHA (JP) 2006-01-19 US disclosed
US-20050287484-A1 Resin-coated carrier for electrophotographic developer CANON KABUSHIKI KAISHA (JP) 2005-12-29 US disclosed
WO-2005121904-A1 CHARGE CONTROL AGENT, TONER, IMAGE FORMING METHOD, AND IMAGE FORMING APPARATUS CANON KABUSHIKI KAISHA (JP) 2005-12-22 WO disclosed
WO-2005121207-A2 POLYHYDROXYALKANOATE HAVING VINYL GROUP, ESTER GROUP, CARBOXYL GROUP, AND SULFONIC GROUP, AND METHOD OF PRODUCING THE SAME CANON KABUSHIKI KAISHA (JP) 2005-12-22 WO disclosed
WO-2005121204-A2 POLYHYDROXYALKANOIC ACID HAVING VINYL, ESTER, CARBOXYL OR SULFONIC ACID GROUP AND PRODUCING METHOD THEREFOR CANON KABUSHIKI KAISHA (JP) 2005-12-22 WO disclosed
WO-2005121205-A2 POLYHYDROXYALKANOATE HAVING ESTER GROUP, CABOXYL GROUP, AND SULFONIC GROUP, AND METHOD OF PRODUCING THE SAME CANON KABUSHIKI KAISHA (JP) 2005-12-22 WO disclosed
WO-2005121206-A2 POLYHYDROXYALKANOATE HAVING VINYL GROUP, ESTER GROUP, CARBOXYL GROUP AND SULFONIC ACID GROUP, AND PRODUCTION METHOD THEREOF CANON KABUSHIKI KAISHA (JP) 2005-12-22 WO disclosed
EP-1579277-A1 POLYHYDROXYALKANOATE CONTAINING AMIDE GROUP, SULFONIC GROUP, AND SULFONATE ESTER GROUP, METHOD FOR PRODUCING THE SAME, AND CHARGE CONTROL AGENT, TONER, IMAGE FORMING METHOD, AND IMAGE FORMING APPARATUS Canon Kabushiki Kaisha (JP) 2005-09-28 EP disclosed
WO-2004061530-A1 POLYHYDROXYALKANOATE CONTAINING AMIDE GROUP, SULFONIC GROUP, AND SULFONATE ESTER GROUP, METHOD FOR PRODUCING THE SAME, AND CHARGE CONTROL AGENT, TONER, IMAGE FORMING METHOD, AND IMAGE FORMING APPARATUS CANON KABUSHIKI KAISHA (JP) 2004-07-22 WO 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 (3 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-11077095-B2 Methods for treating neurodegenerative disorders NLN, CLN6, SNCA NOS3 2091/4885NOS2 2550/4885TSHR 4525/4885
US-12036208-B2 Methods for treating neurodegenerative disorders NLN, CLN6, SNCA NOS3 2091/4885NOS2 2550/4885TSHR 4525/4885
US-20160101091-A1 ALKYLAMINE DERIVATIVE CASR, TAAR5, TAAR1 NOS3 1972/4885NOS2 1694/4885TSHR 313/4885

“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.