SCHEMBL855214

SCHEMBL855214

O=C1OC(=O)c2c(Br)c(Br)cc(Br)c21

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
AHR P35869 3/20 0.35
ALDH1A1 P00352 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
APEX1 P27695 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
SCHEMBL29688935 0.74 TSHR (0.52) TSHRAHRALDH1A1CA1CA2
SCHEMBL855646 0.74 TSHR (0.52) TSHRAHRALDH1A1CA1CA2
SCHEMBL29376586 0.73 TSHR (1.00) TSHRALDH1A1CA1CA2CA4
SCHEMBL194752 0.73 TSHR (1.00) TSHRALDH1A1CA1CA2CA4
SCHEMBL195704 0.73 TSHR (0.52) TSHRAHRALDH1A1
SCHEMBL30443943 0.73 TSHR (0.52) TSHRAHRALDH1A1
SCHEMBL38664107 0.71 TSHR (0.94) TSHRALDH1A1CA1CA2CA4
Magnesium SCHEMBL31583965 0.71 TSHR (0.94) TSHRALDH1A1CA1CA2CA4
SCHEMBL18098042 0.71 TSHR (0.82) TSHRALDH1A1CA1CA2CA4
Ammonia Solution, Strong SCHEMBL7773774 0.71 TSHR (0.94) TSHRALDH1A1CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113999101-A Synthetic method of anthraquinone derivative SZ-685C 广东海洋大学 2022-02-01 CN claimed
CN-113999101-B Synthesis method of anthraquinone derivative SZ-685C 广东海洋大学 2024-03-26 CN disclosed
US-20230323137-A1 COMPOSITION FOR SEALING COATED ELECTRIC WIRE, AND COATED ELECTRIC WIRE TOAGOSEI CO. LTD. (JP) 2023-10-12 US disclosed
CN-113999101-A Synthetic method of anthraquinone derivative SZ-685C 广东海洋大学 2022-02-01 CN disclosed
EP-3260509-B1 2-CYANOACRYLATE ADHESIVE COMPOSITION TOAGOSEI CO LTD (JP) 2021-04-07 EP disclosed
CN-107250302-B 2-cyanoacrylate-based adhesive composition 东亚合成株式会社 2021-02-26 CN disclosed
US-10647888-B2 2-cyanoacrylate adhesive composition TOAGOSEI CO., LTD. (JP) 2020-05-12 US disclosed
EP-2433933-B1 PRODUCTION METHOD OF TRI- OR TETRAHALOGEN-SUBSTITUTED PHTHALIDE SUMITOMO CHEMICAL CO (JP) 2019-05-08 EP disclosed
CN-105849094-B The manufacture method of halogen-substituted phthalein 住友化学株式会社 2018-04-10 CN disclosed
US-20180037772-A1 2-CYANOACRYLATE ADHESIVE COMPOSITION TOAGOSEI CO., LTD. (JP) 2018-02-08 US disclosed
EP-3260509-A1 2-CYANOACRYLATE ADHESIVE COMPOSITION Toagosei Co., Ltd. (JP) 2017-12-27 EP disclosed
CN-105849094-A Method for producing halogen-substituted phthalide 住友化学株式会社 2016-08-10 CN disclosed
US-8604221-B2 Production method of halogen-substituted phthalide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-12-10 US disclosed
US-20120142946-A1 PRODUCTION METHOD OF HALOGEN-SUBSTITUTED PHTHALIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-06-07 US disclosed
EP-2433933-A1 PRODUCTION METHOD OF HALOGEN-SUBSTITUTED PHTHALIDE Sumitomo Chemical Company, Limited (JP) 2012-03-28 EP disclosed
US-5137948-A Condensation of hydrazine and halogenated dicarboxylic acid anhydride ATOCHEM (FR) 1992-08-11 US disclosed
US-4894187-A HALOGENATED IMIDES IN PLASTICS ATOCHEM (FR) 1990-01-16 US disclosed
US-4515964-A Polyhalophthalimidoalkyl-functional carbonates PPG INDUSTRIES, INC. (US) 1985-05-07 US disclosed
US-4414396-A FIREPROOFING PPG INDUSTRIES, INC. (US) 1983-11-08 US 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 (2 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-10647888-B2 2-cyanoacrylate adhesive composition COL2A1, COL14A1, ICAM1 TSHR 4872/4885AHR 3290/4885ALDH1A1 288/4885
US-20180037772-A1 2-CYANOACRYLATE ADHESIVE COMPOSITION COL2A1, COL14A1, ICAM1 TSHR 4872/4885AHR 3290/4885ALDH1A1 288/4885

“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.