SCHEMBL4646418

SCHEMBL4646418

C#CCCC(C)(C)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
SCHEMBL16685935 0.83
SCHEMBL22497794 0.81
SCHEMBL6141371 0.75
SCHEMBL8427780 0.72
SCHEMBL6893105 0.72
SCHEMBL7712045 0.71
SCHEMBL6247753 0.71
SCHEMBL1016480 0.71
SCHEMBL950247 0.71
Tert-Butanol SCHEMBL6429201 0.71 ALDH1A1 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110023534-A Cobalt compounds and methods of making and using the same 弗萨姆材料美国有限责任公司 2019-07-16 CN claimed
CN-101925858-B Polychromic substance and use thereof DATALASE LTD 2012-12-19 CN claimed
CN-101925858-A Polychromic substance and use thereof DATALASE LTD 2010-12-22 CN claimed
US-20250304576-A1 IKK INHIBITORS CANCER RESEARCH TECH LTD (GB) 2025-10-02 US disclosed
EP-4004000-B1 THIENOPYRIDINYL AND THIAZOLOPYRIDINYL COMPOUNDS USEFUL AS IRAK4 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2025-07-09 EP disclosed
US-12304916-B2 Thienopyridinyl and thiazolopyridinyl compounds useful as IRAK4 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2025-05-20 US disclosed
CN-115335043-B PGDH inhibitors and methods of making and using the same 迈欧伏特治疗公司 2025-03-28 CN disclosed
EP-3947378-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF INFLAMMATORY DISORDERS GALAPAGOS NV (BE) 2024-11-13 EP disclosed
US-20240262820-A1 PGDH INHIBITORS AND METHODS OF MAKING AND USING MYOFORTE THERAPEUTICS, INC. 2024-08-08 US disclosed
WO-2024129763-A1 MODULATORS OF TNF-α ACTIVITY FORWARD THERAPEUTICS, INC. (US) 2024-06-20 WO disclosed
CN-118125978-A MYC inhibitor and preparation method and application thereof 安徽中医药大学 2024-06-04 CN disclosed
US-20080293782-A1 1,1,3-Trioxo-1,2,5-Thiadiazolidines and Their Use as Ptp-Ases Inhibitors NOVARTIS AG (CH) 2008-11-27 US disclosed
EP-1960377-A1 l , l , 3-TRI0X0-l , 2 , 5-THIADIAZ0LIDINES AND THEIR USE AS PTP-ASES INHIBITORS Novartis AG (CH) 2008-08-27 EP disclosed
WO-2007067614-A1 l, l, 3-TRI0X0-l, 2, 5-THIADIAZ0LIDINES AND THEIR USE AS PTP-ASES INHIBITORS NOVARTIS AG (CH) 2007-06-14 WO disclosed
WO-2005044008-A2 2 -AMINOTHIOPHENE COMPOUNDS AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2005-05-19 WO disclosed
US-6013814-A Vitamin D analogues RESEARCH INSTITUTE FOR MEDICINE AND CHEMISTRY, INC. (US) 2000-01-11 US disclosed
US-5872140-A Vitamin D analogues RESEARCH INSTITUTE FOR MEDICINE AND CHEMISTRY, INC. (US) 1999-02-16 US disclosed
EP-0710227-B1 VITAMIN D ANALOGUES RES INST MEDICINE CHEM (US) 1998-10-21 EP disclosed
EP-0710227-A1 VITAMIN D ANALOGUES RESEARCH INSTITUTE FOR MEDICINE AND CHEMISTRY INC. (US) 1996-05-08 EP disclosed
WO-1995003273-A1 VITAMIN D ANALOGUES HOLMES, MICHAEL, JOHN (GB) 1995-02-02 WO disclosed