SCHEMBL101539

SCHEMBL101539

C[CH]C(C)C(C)CCC

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
SCHEMBL1003750 0.83 DNM1 (0.36)
SCHEMBL2004955 0.78 METAP1 (0.32)
SCHEMBL2004956 0.78 METAP1 (0.32)
SCHEMBL101392 0.75
SCHEMBL11939964 0.74
SCHEMBL4756088 0.74
SCHEMBL28153781 0.74 METAP1 (0.33)
SCHEMBL1410409 0.74
SCHEMBL4990515 0.74
SCHEMBL27741605 0.74 METAP1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10202322-B2 Resorcinol derivatives SUTTER BAY HOSPITALS (US) 2019-02-12 US claimed
US-20180170846-A1 RESORCINOL DERIVATIVES SUTTER WEST BAY HOSPITALS 2018-06-21 US claimed
US-20130209483-A1 CANNABIDINOID DERIVATIVES SUTTER WEST BAY HOSPITALS (US) 2013-08-15 US claimed
CN-114728183-B Hair conditioning product comprising a first composition and a second composition 宝洁公司 2024-07-09 CN disclosed
EP-3727324-B1 LOW VISCOSITY CONDITIONER COMPOSITION CONTAINING SILICONE POLYMERS PROCTER & GAMBLE (US) 2024-06-26 EP disclosed
CN-118217178-A Personal care compositions comprising water insoluble solid organic compounds 宝洁公司 2024-06-21 CN disclosed
CN-118203511-A Personal care products tailored from discrete particles and methods of application thereof 宝洁公司 2024-06-18 CN disclosed
US-20240189214-A1 Silicone Mixture for Hair Conditioning THE PROCTER & GAMBLE COMPANY 2024-06-13 US disclosed
US-20240180806-A1 PERSONAL CARE COMPOSITION COMPRISING WATER INSOLUBLE SOLID ORGANIC COMPOUND PROCTER & GAMBLE (US) 2024-06-06 US disclosed
WO-2024118698-A1 SILICONE MIXTURE FOR HAIR CONDITIONING THE PROCTER & GAMBLE COMPANY (US) 2024-06-06 WO disclosed
CN-112804984-B Personal care products tailored from discrete particles and methods of application thereof 宝洁公司 2024-05-28 CN disclosed
EP-0889057-B1 Process for hydrogenating conjugated diene polymer ASAHI CHEMICAL IND (JP) 2003-01-08 EP disclosed
EP-1219631-A1 ANTIANDROGEN AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-07-03 EP disclosed
US-5886108-A Process for hydrogenating conjugated diene polymer ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1999-03-23 US disclosed
EP-0889057-A1 Process for hydrogenating conjugated diene polymer ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1999-01-07 EP disclosed
EP-0135252-A2 Process for preparing 3-substituted-3-aminonitrile ELI LILLY AND COMPANY (US) 1985-03-27 EP disclosed
EP-0129408-A2 (3-alkyl-5-isothiazolyl)ureas ELI LILLY AND COMPANY (US) 1984-12-27 EP disclosed
US-4092344-A Cyclohexenyl resorcinol derivatives ELI LILLY AND COMPANY (US) 1978-05-30 US disclosed
US-4075230-A Preparation of optically active trans-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1978-02-21 US disclosed
US-4054583-A Process for converting 2,7-dihydroxy-5-isopropylidene-9-substituted-2,6-methano-3,4,5,6-tetrahydro-2H-1-benzoxocin to trans-1-hydroxy-3-substituted-6,6-dimethyl-6,6a,7,8,10,10a-hexahydro-9H-dibenzo(b,d)pyran-9-one ELI LILLY AND COMPANY (US) 1977-10-18 US disclosed