SCHEMBL6192049

SCHEMBL6192049

[CH2]C=CC(C)(C)CC

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
SCHEMBL8392179 1.00
SCHEMBL27974674 0.79 TSHR (0.43)
SCHEMBL23069458 0.73
SCHEMBL182083 0.73
SCHEMBL3668978 0.73
SCHEMBL18996697 0.71
SCHEMBL8534853 0.71
SCHEMBL11748803 0.71
SCHEMBL7290555 0.69
SCHEMBL3162528 0.69

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
US-20230250218-A1 URETHANE COMPOSITION NITTO KASEI CO., LTD. (JP) 2023-08-10 US disclosed
EP-4198068-A1 URETHANE COMPOSITION Nitto Kasei Co., Ltd. (JP) 2023-06-21 EP disclosed
CN-116018365-A Carbamate composition 日东化成株式会社 2023-04-25 CN disclosed
EP-1501361-A1 3-HETEROARYL SUBSTITUTED 5-METHYLOXYMETHYL ISOXAZOLINES USED AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2005-02-02 EP disclosed
WO-2003090539-A1 3-HETEROARYL SUBSTITUTED 5-METHYLOXYMETHYL ISOXAZOLINES USED AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2003-11-06 WO disclosed
CN-1084190-C Dermatologic preparation composition containing prostacyclin as active ingredient TEIJIN LTD (JP) 2002-05-08 CN disclosed
US-5965611-A TREATING CHRONIC PERIPHERAL ARTERIAL OCCLUSION BY ADMINISTERING EMULSION COMPRISING ISOCARBACYCLIN, VEGETABLE OIL, PHOSPHOLIPID, AND WATER TEIGIN LIMITED (JP) 1999-10-12 US disclosed
EP-0634171-B1 PHARMACEUTICAL COMPOSITION FOR TREATING CEREBRAL THROMBOSIS TEIJIN LTD (JP) 1999-05-06 EP disclosed
US-5656663-A THERAPY FOR SKIN ULCERS TEIJIN LIMITED (JP) 1997-08-12 US disclosed
CN-1151698-A Pharmaceutical compsn. for treating peripheral circulation disorder TEIJIN LTD (JP) 1997-06-11 CN disclosed
EP-0761225-A1 PHARMACEUTICAL COMPOSITION FOR TREATING PERIPHERAL CIRCULATION DISORDER TEIJIN LIMITED (JP) 1997-03-12 EP disclosed
US-5610182-A ADMINISTERING AN ISOCARBACYCLIN OF SPECIFIC STRUCTURE IN THE FORM OF A FAT EMULSION TEIJIN, LIMITED (JP) 1997-03-11 US disclosed
US-5530027-A PROSTAGLANDINS AND/OR ITS OPTICAL ISOMER FOR SKIN DISORDERS TEIJIN LIMITED (JP) 1996-06-25 US disclosed
CN-1102038-A External skin therapeutic agent composition containing prostacyclin as active ingredient TEIJIN LTD (JP) 1995-04-26 CN disclosed
CN-1102039-A External skin therapeutic agent composition containing isocarbacyclin as active ingredient TEIJIN LTD (JP) 1995-04-26 CN disclosed
CN-1101781-A Pharmaceutical composition for treating cerebral thrombosis TEIJIN LTD (JP) 1995-04-19 CN disclosed
EP-0638312-A1 DERMATOLOGIC PREPARATION COMPOSITION CONTAINING ISOCARBACYCLIN AS ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1995-02-15 EP disclosed
EP-0634172-A1 DERMATOLOGIC PREPARATION COMPOSITION CONTAINING PROSTACYCLIN AS ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1995-01-18 EP disclosed
EP-0634171-A1 PHARMACEUTICAL COMPOSITION FOR TREATING CEREBRAL THROMBOSIS TEIJIN LIMITED (JP) 1995-01-18 EP disclosed