SCHEMBL203931

SCHEMBL203931

O=C(CBr)c1ccc(C(F)(F)F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 8/20 1.00
▸ PTPN1 P18031 6/20 1.00
▸ CES2 O00748 1/20 0.59
▸ CES1 P23141 1/20 0.59
▸ MMP1 P03956 1/20 0.56
▸ SRD5A2 P31213 1/20 0.52
▸ HSD11B1 P28845 1/20 0.51
▸ HDAC1 Q13547 1/20 0.51
▸ HDAC8 Q9BY41 1/20 0.51

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
Formaldehyde SCHEMBL28094444 0.96 GSK3B (0.92) GSK3BPTPN1CES2CES1MMP1
SCHEMBL31557731 0.86 PTPN1 (0.75) GSK3BPTPN1CES2CES1MMP1
SCHEMBL26135918 0.83 MMP1 (0.76) GSK3BPTPN1CES2CES1MMP1
SCHEMBL29987081 0.83 PTPN1 (0.75) GSK3BPTPN1CES2CES1MMP1
SCHEMBL30989548 0.82 GSK3B (0.69) GSK3BPTPN1CES2
SCHEMBL205280 0.82 GSK3B (0.80) GSK3BPTPN1HDAC1HDAC8
SCHEMBL2074662 0.81 PTPN1 (0.68) GSK3BPTPN1CES2CES1MMP1
SCHEMBL1360049 0.81 PTPN1 (0.68) GSK3BPTPN1CES2CES1MMP1
SCHEMBL11095198 0.81 PTPN1 (0.67) GSK3BPTPN1CES2CES1MMP1
SCHEMBL4330199 0.81 PTPN1 (0.65) GSK3BPTPN1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12509819-B2 Micro-nano structure-based super-hydrophobic fabric and preparation method therefor SOOCHOW UNIVERSITY (CN) 2025-12-30 — — US claimed
CN-120081843-A Fluorescent probe for quantitatively detecting NO in exhaled breath, and preparation method and application thereof 阜阳师范大学 2025-06-03 — — CN claimed
CN-118930487-A 1,3, 5-Trisubstituted pyrazole compound and preparation method thereof 赣南师范大学 2024-11-12 — — CN claimed
EP-3959200-B1 NEW TRIAZOLE AND TRIAZOLOTHIADIAZINE DERIVATIVES EXERTING CYTOTOXIC AND APOPTOTIC EFFECTS ON A549 CELLS THROUGH AKT INHIBITION ANADOLU UNIV (TR) 2024-03-20 — — EP claimed
US-20230416977-A1 MICRO-NANO STRUCTURE-BASED SUPER-HYDROPHOBIC FABRIC AND PREPARATION METHOD THEREFOR SOOCHOW UNIVERSITY (CN) 2023-12-28 — — US claimed
EP-3958980-B1 TARGETED NOVEL TRIAZOLOTHIADIAZINE DERIVATIVES FOR THE TREATMENT OF LUNG CANCER ANADOLU UNIV (TR) 2023-11-15 — — EP claimed
CN-115785189-B 5 alpha, 8 alpha-peroxosterol-17-phenylthiazole derivative and synthetic method and application thereof 齐齐哈尔医学院 2023-08-25 — — CN claimed
CN-115852684-A Cotton fabric dyeing method 绍兴市上虞丰达染整有限公司 2023-03-28 — — CN claimed
CN-115785189-A 5 alpha, 8 alpha-peroxysterol-17-phenylthiazole derivative and synthetic method and application thereof 齐齐哈尔医学院 2023-03-14 — — CN claimed
WO-2022165777-A1 MICRO-NANO STRUCTURE-BASED SUPER-HYDROPHOBIC FABRIC AND PREPARATION METHOD THEREFOR 苏州大学 2022-08-11 — — WO claimed
CN-112878053-B Micro-nano structure based super-hydrophobic fabric and preparation method thereof 苏州大学 2022-03-15 — — CN claimed
WO-2021257020-A1 TARGETED NOVEL TRIAZOLOTHIADIAZINE DERIVATIVES FOR THE TREATMENT OF LUNG CANCER ANADOLU ÜNİVERSİTESİ (TR) 2021-12-23 — — WO claimed
CN-113234066-A Propiconazole-like compound and preparation method and application thereof 浙江工业大学 2021-08-10 — — CN claimed
US-20260098036-A1 2-HETEROARYL-3-OXO-2,3-DIHYDROPYRIDAZINE-4-CARBOXAMIDES FOR THE TREATMENT OF CANCER DEUTSCHES KREBSFORSCHUNGSZENTRUM (DE) 2026-04-09 — — US disclosed
US-20260070905-A1 Derivatives of Imidazo[1,2-A]Pyridine with Anti-Inflammatory Activity UNIV DE VELENCIA (ES) 2026-03-12 — — US disclosed
US-12522594-B2 2-heteroaryl-3-oxo-2,3-dihydropyridazine-4-carboxamides for the treatment of cancer DEUTSCHES KREBSFORSCHUNGSZENTRUM (DE) 2026-01-13 — — US disclosed
US-4265898-A ANTICOAGULANTS BAYER AKTIENGESELLSCHAFT (DE) 1981-05-05 — — US disclosed
EP-0005783-A1 Imidazo (2.1-b)-(1.3.4)-thiadiazoles, process for their preparation and their use in medicaments BAYER AG (DE) 1979-12-12 — — EP disclosed
US-4143148-A ANTI-ULCER THIAZOLINE DERIVATIVES JOHN WYETH & BROTHER LIMITED (GB) 1979-03-06 — — US disclosed
US-3965181-A Tricyclic pharmacological agents, intermediates and methods of making SYNTEX (U.S.A.) INC. (US) 1976-06-22 — — 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 (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-20260098036-A1 2-HETEROARYL-3-OXO-2,3-DIHYDROPYRIDAZINE-4-CARBOXAMIDES FOR THE TREATMENT OF CANCER AHR, CBR1, CNR1 GSK3B 2364/4885PTPN1 1040/4885CES2 994/4885
US-12509819-B2 Micro-nano structure-based super-hydrophobic fabric and preparation method therefor KIT, MYB, MAST1 GSK3B 1838/4885PTPN1 1118/4885CES2 281/4885
US-20260070905-A1 Derivatives of Imidazo[1,2-A]Pyridine with Anti-Inflammatory Activity IL1A, IL6, IL1B GSK3B 3354/4885PTPN1 1200/4885CES2 575/4885

“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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