SCHEMBL477922

SCHEMBL477922

C#CC(C)(C)C(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL17392903 1.00
SCHEMBL15447175 0.75
SCHEMBL3109791 0.75
Bicarbonate SCHEMBL5539995 0.73 TSHR (0.39)
SCHEMBL15200868 0.73
SCHEMBL6722168 0.73
SCHEMBL17870937 0.73
SCHEMBL11091238 0.73
SCHEMBL7064786 0.71
SCHEMBL5165354 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120136965-A Isolated polypeptide of targeted MPP8 protein and application thereof 苏州系统医学研究所 2025-06-13 CN claimed
EP-2864312-B1 NOVEL ANTI-CANCER THIOPHENE COMPOUNDS UNIV LEUVEN KATH (BE) 2021-09-22 EP claimed
EP-4720041-A2 N-(1H-INDOL-2-YL)METHYL)-4-ETHYNYL-PICOLINAMIDE DERIVATIVES AS EGFR INHIBITORS FOR THE TREATMENT OF CANCER Allorion Therapeutics Inc (US) 2026-04-08 EP disclosed
CN-120136965-A Isolated polypeptide of targeted MPP8 protein and application thereof 苏州系统医学研究所 2025-06-13 CN disclosed
US-RE50453-E1 Indole derivatives as CFTR modulators VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-06-10 US disclosed
US-20250026763-A1 EGFR INHIBITORS AND METHODS OF USE THEREOF Allorion Therapeutics Inc 2025-01-23 US disclosed
WO-2024240241-A2 EGFR INHIBITORS AND METHODS OF USE THEREOF Allorion Therapeutics Inc (US) 2024-11-28 WO disclosed
US-12129221-B2 Difluoro phenyl amide RIP1 inhibitor SIRONAX LTD (KY) 2024-10-29 US disclosed
US-20240218021-A1 CYCLIN INHIBITORS CIRCLE PHARMA, INC. 2024-07-04 US disclosed
WO-2024129763-A1 MODULATORS OF TNF-α ACTIVITY FORWARD THERAPEUTICS, INC. (US) 2024-06-20 WO disclosed
US-20240109898-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE-7-AMINE DERIVATIVES, COMPOSITIONS AND PHARMACEUTICAL USES THEREOF SHANGHAI HAIYAN PHARMACEUTICAL TECHNOLOGY CO., LTD. (CN) 2024-04-04 US disclosed
US-6133240-A INHIBITION OF SELECTINS, AND THUS OF CELL ADHESION DARWIN DISCOVERY, LTD. (GB) 2000-10-17 US disclosed
EP-0931086-A1 TETRAHYDRONAPHTHALENE DERIVATIVES AND THEIR THERAPEUTIC USE Darwin Discovery Limited (GB) 1999-07-28 EP disclosed
WO-1998009977-A1 TETRAHYDRONAPTHALENE DERIVATIVES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LIMITED (GB) 1998-03-12 WO disclosed
US-4898608-A Pyridylthio-acylanilide herbicides BAYER AKTIENGESELLSCHAFT (DE) 1990-02-06 US disclosed
EP-0129928-B1 OXAZOLYL-SUBSTITUTED DIAZAHETEROCYCLES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-09-02 EP disclosed
EP-0136754-A1 Thiadiazole herbicides SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1985-04-10 EP disclosed
US-4500345-A IOSTEMERGENCE AND PREEMERGENCE HERBICIDES SHELL OIL COMPANY (US) 1985-02-19 US disclosed
US-4493728-A HERBICIDES SHELL OIL COMPANY (US) 1985-01-15 US disclosed
EP-0129928-A1 Oxazolyl-substituted diazaheterocycles SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1985-01-02 EP disclosed