SCHEMBL17044673

SCHEMBL17044673

C=COc1ccc(C#N)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
CA1 P00915 1/20 0.44
MAOB P27338 2/20 0.42
ALDH1A1 P00352 2/20 0.41
CYP2A6 P11509 2/20 0.41
CA12 O43570 1/20 0.41
CA3 P07451 1/20 0.41
CA6 P23280 1/20 0.41
CA14 Q9ULX7 1/20 0.41
PARP15 Q460N3 1/20 0.40
PARP10 Q53GL7 1/20 0.40
PARP2 Q9UGN5 1/20 0.40
MAPT P10636 2/20 0.39
CYP19A1 P11511 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL21207323 0.94 MMP3 (0.47) CA2CA9CA1MAOBALDH1A1
SCHEMBL15045550 0.84 HRH3 (0.39) CA2CA9CA1HRH3
SCHEMBL5316832 0.83 CA2 (0.41) CA2CA9CA1MAOBALDH1A1
SCHEMBL473606 0.80 CHRNB2 (0.34) CA2CA9CA1ALDH1A1CA12
SCHEMBL195649 0.77 CA2 (0.48) CA2CA9CA1MAOBALDH1A1
SCHEMBL13665406 0.77 CA2 (0.48) CA2CA9CA1MAOBALDH1A1
SCHEMBL535439 0.77 ALDH1A1 (0.46) CA2CA9CA1MAOBALDH1A1
SCHEMBL1400344 0.74 CA1 (0.50) CA2CA9CA1MAOBALDH1A1
SCHEMBL586990 0.74 ALDH1A1 (0.51) MAOBALDH1A1MAPTMMP2HRH3
SCHEMBL535406 0.73 CA2 (0.48) CA2CA9CA1MAOBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250092171-A1 HIGH-PURITY 4-(2-BROMOETHYL)BENZENESULFONIC ACID, HIGH-PURITY STYRENESULFONIC ACID COMPOUND DERIVED THEREFROM, AND POLYMER THEREOF, AND METHODS FOR PRODUCING SAME TOSOH FINECHEM CORPORATION (JP) 2025-03-20 US disclosed
CN-118843614-A High-purity 4- (2-bromoethyl) benzenesulfonic acid, high-purity styrenesulfonic acid derived therefrom, polymer thereof, and process for producing these 东曹精细化工株式会社 2024-10-25 CN disclosed
EP-3666753-B1 HIGH-PURITY AMPHIPATHIC ARYLSULFONIC ACID AMINE SALT VINYL MONOMER AND COPOLYMER THEREOF TOSOH FINECHEM CORP (JP) 2024-09-11 EP disclosed
US-20240191087-A1 WATER DISPERSIBLE SULFONATED THERMOPLASTIC COPOLYMER FOR USE IN ADDITIVE MANUFACTURING STRATASYS INC (US) 2024-06-13 US disclosed
US-11939480-B2 Water dispersible sulfonated thermoplastic copolymer for use in additive manufacturing STRATASYS, INC. (US) 2024-03-26 US disclosed
WO-2023171597-A1 HIGH-PURITY 4-(2-BROMOETHYL)BENZENESULFONIC ACID, HIGH-PURITY STYRENESULFONIC ACIDS DERIVED THEREFROM AND POLYMERS THEREOF, AND METHODS FOR PRODUCING SAME 東ソー・ファインケム株式会社 2023-09-14 WO disclosed
US-11459410-B2 High-purity amphipathic arylsulfonic acid amine salt vinyl monomer and copolymer thereof TOSOH FINECHEM CORPORATION (JP) 2022-10-04 US disclosed
CN-110997631-B High purity amphiphilic arylsulfonic acid amine salt vinyl monomers and (co) polymers thereof 东曹精细化工株式会社 2022-07-15 CN disclosed
US-11220062-B2 Water-dispersible thermoplastic material comprising sulfonated copolymer for use in additive manufacturing STRATASYS, INC. (US) 2022-01-11 US disclosed
US-20210348010-A1 WATER DISPERSIBLE SULFONATED THERMOPLASTIC COPOLYMER FOR USE IN ADDITIVE MANUFACTURING STRATASYS, INC. 2021-11-11 US disclosed
EP-3666753-A1 HIGH-PURITY AMPHIPATHIC ARYLSULFONIC ACID AMINE SALT VINYL MONOMER AND COPOLYMER THEREOF Tosoh Finechem Corporation (JP) 2020-06-17 EP disclosed
US-20200172643-A1 HIGH-PURITY AMPHIPATHIC ARYLSULFONIC ACID AMINE SALT VINYL MONOMER AND COPOLYMER THEREOF TOSOH FINECHEM CORPORATION (JP) 2020-06-04 US disclosed
CN-104736516-B Sodium p-styrenesulfonate, process for producing the same, sodium p-styrenesulfonate, dispersant using the same, and synthetic paste for dressing 东曹精细化工株式会社 2019-11-08 CN disclosed
WO-2019075107-A1 WATER-DISPERSIBLE THERMOPLASTIC MATERIAL COMPRISING SULFONATED COPOLYMER FOR USE IN ADDITIVE MANUFACTURING STRATASYS, INC. (US) 2019-04-18 WO disclosed
US-20180030234-A1 RECYCLING AND REUSE OF SULFONATED POLYMER MATERIAL IN ADDITIVE MANUFACTURING STRATASYS, INC. 2018-02-01 US disclosed
US-9505713-B2 High-purity sodium p-styrenesulfonate with excellent hue, method for producing the same, poly(sodium p-styrenesulfonate) with excellent hue using the same, and dispersant and synthetic starch for clothing finishing using the poly(sodium p-styrenesulfonate) TOSOH ORGANIC CHEMICAL CO., LTD (JP) 2016-11-29 US disclosed
CN-103958552-B The manufacture method of high-purity sodium p styrene sulfonate and the manufacture method of kayexalate 东曹有机化学株式会社 2016-11-16 CN disclosed
US-20150246876-A1 HIGH-PURITY SODIUM P-STYRENESULFONATE WITH EXCELLENT HUE, METHOD FOR PRODUCING THE SAME, POLY (SODIUM P-STYRENESULFONATE) WITH EXCELLENT HUE USING THE SAME, AND DISPERSANT AND SYNTHETIC STARCH FOR CLOTHING FINISHING USING THE POLY ( SODIUM P-STYRENESULFONATE) TOSOH ORGANIC CHEMICAL CO., LTD. (JP) 2015-09-03 US disclosed
CN-104736516-A High-purity sodium p-styrenesulfonate having excellent hue, process for producing the same, sodium polystyrenesulfonate having excellent hue using the same, dispersant using the sodium polystyrenesulfonate, and synthetic paste for finishing clothing TOSOH ORGANIC CHEMICAL CO LTD 2015-06-24 CN disclosed
CN-103958552-A High-purity parastyrene sulfonic acid (salt) TOSOH ORGANIC CHEMICAL CO LTD 2014-07-30 CN 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 (4 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-11459410-B2 High-purity amphipathic arylsulfonic acid amine salt vinyl monomer and copolymer thereof SLC7A1, ARSA, STS CA2 2972/4885CA9 2904/4885CA1 3904/4885
US-20200172643-A1 HIGH-PURITY AMPHIPATHIC ARYLSULFONIC ACID AMINE SALT VINYL MONOMER AND COPOLYMER THEREOF SLC7A1, ARSA, STS CA2 2972/4885CA9 2904/4885CA1 3904/4885
US-20150246876-A1 HIGH-PURITY SODIUM P-STYRENESULFONATE WITH EXCELLENT HUE, METHOD FOR PRODUCING THE SAME, POLY (SODIUM P-STYRENESULFONATE) WITH EXCELLENT HUE USING THE SAME, AND DISPERSANT AND SYNTHETIC STARCH FOR CLOTHING FINISHING USING THE POLY ( SODIUM P-STYRENESULFONATE) HPSE, STS, TST CA2 3515/4885CA9 2798/4885CA1 4090/4885
US-20250092171-A1 HIGH-PURITY 4-(2-BROMOETHYL)BENZENESULFONIC ACID, HIGH-PURITY STYRENESULFONIC ACID COMPOUND DERIVED THEREFROM, AND POLYMER THEREOF, AND METHODS FOR PRODUCING SAME BRPF1, WEE2, WEE1 CA2 4639/4885CA9 4280/4885CA1 4151/4885

“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.