SCHEMBL2576284

SCHEMBL2576284

O=S(=O)=Nc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.45
▸ MIF P14174 1/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ HTR3E A5X5Y0 1/20 0.36
▸ SLC22A2 O15244 1/20 0.36
▸ SLC22A1 O15245 1/20 0.36
▸ SLC22A3 O75751 1/20 0.36
▸ HTR3B O95264 1/20 0.36
▸ PLAU P00749 1/20 0.36
▸ HTR3A P46098 1/20 0.36
▸ HTR3D Q70Z44 1/20 0.36
▸ HTR3C Q8WXA8 1/20 0.36
▸ TRPA1 O75762 1/20 0.36
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ MAPT P10636 3/20 0.35
▸ NOS1 P29475 3/20 0.35
▸ NOS3 P29474 2/20 0.35
▸ PKM P14618 1/20 0.35
▸ HTT P42858 1/20 0.35

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
Toluene SCHEMBL10442875 0.88 LMNA (0.50) ALDH1A1HTR3EHTR3BHTR3AHTR3D
Phenol SCHEMBL27827991 0.88 TDP1 (0.50) ALDH1A1HTR3ESLC22A2SLC22A1SLC22A3
SCHEMBL27438595 0.85 ALDH1A1 (0.43) ALDH1A1MAPTHTTTDP1MAPK1
Benzene SCHEMBL27557810 0.84 NOS3 (0.36) ALDH1A1EPHX2HTR3ESLC22A2SLC22A1
SCHEMBL11489781 0.81 LTA4H (0.52) NOS1NOS3HTTTSHRLTA4H
Acrylonitrile SCHEMBL29071613 0.81 ALDH1A1 (0.35) ALDH1A1MIFTSHR
SCHEMBL28658691 0.79 MAOB (0.45) ALDH1A1TRPA1MEN1KMT2AMAPT
SCHEMBL28673479 0.78 ALDH1A1 (0.56) ALDH1A1TRPA1MEN1KMT2AMAPT
Benzene SCHEMBL28711563 0.74 LTA4H (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL28819400 0.72 TSHR (0.55) ALDH1A1TRPA1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120199833-A Preparation method of nitrogen-doped carbon-coated ionomer catalyst and application of nitrogen-doped carbon-coated ionomer catalyst in fuel cell 江苏源氢新能源科技股份有限公司 2025-06-24 — — CN claimed
CN-118325502-B Polymer self-adhesive waterproof coiled material and preparation method thereof 河北豫源防水材料有限公司 2024-11-08 — — CN claimed
CN-118325502-A Polymer self-adhesive waterproof coiled material and preparation method thereof 河北豫源防水材料有限公司 2024-07-12 — — CN claimed
CN-118290962-A Preparation and application of reactive dye for printing and dyeing poly azo cotton fabric 上海工程技术大学 2024-07-05 — — CN claimed
US-20240172753-A1 AGRICULTURAL FORMULATIONS STEPAN COMPANY 2024-05-30 — — US claimed
CN-117661138-A Indication label for detecting freshness of lobsters based on micromolecular dye and preparation method 江苏省农业科学院 2024-03-08 — — CN claimed
CN-117534706-A Sulfonyl anilide berberine phosphate conjugate, and preparation method and application thereof 西南大学 2024-02-09 — — CN claimed
EP-4312553-A1 AGRICULTURAL FORMULATIONS Stepan Company (US) 2024-02-07 — — EP claimed
CN-117264684-A Low-odor environment-friendly industrial gear oil composition and application thereof 中国石油化工股份有限公司 2023-12-22 — — CN claimed
CN-117143454-A Physical antibacterial silica gel material and preparation method and application thereof 安徽硅颜新材料科技有限公司 2023-12-01 — — CN claimed
CN-116496217-A Multi-targeting cross-linking agent, and preparation and application thereof 上海科技大学 2023-07-28 — — CN claimed
CN-114766484-A Crystal modification of propanil UPL 有限公司 2022-07-22 — — CN claimed
US-6998490-B2 Process for the preparation of organic compounds containing a sulfinyl or sulfonyl group DINAMITE DIPHARMA S.P.A. (IT) 2006-02-14 — — US claimed
US-4117003-A COMPLEMENT INHIBITORS AMERICAN CYANAMID COMPANY (US) 1978-09-26 — — US claimed
JP-2295921-A — — None — — JP disclosed
JP-59195238-A — — None — — JP disclosed
JP-1156953-A — — None — — JP disclosed
US-4026931-A AZO DYES, FIBER-REACTIVE; INDOLE OR 5-AMINO-PYRAZOLE COUPLING COMPONENT BAYER AKTIENGESELLSCHAFT (DT) 1977-05-31 — — US disclosed
US-4024123-A TEXTILES DUSSY PAUL 1977-05-17 — — US disclosed
US-3947480-A Dinitro- and diamino arylene disulfones UNIROYAL, INC. (US) 1976-03-30 — — 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 (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-20240172753-A1 AGRICULTURAL FORMULATIONS PNPO, IP6K3, PHOSPHO1 ALDH1A1 4708/4885MIF 3288/4885EPHX2 455/4885

“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.

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