SCHEMBL1472450

SCHEMBL1472450

CC1(C)CCCC(C)(COC=O)C1

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
SCHEMBL17030650 0.81
SCHEMBL7036514 0.79 HPGD (0.36)
SCHEMBL1471434 0.72 CYP19A1 (0.33)
SCHEMBL9245777 0.71
SCHEMBL12213028 0.69
Ethoxycarbonyl Group SCHEMBL28279688 0.69
SCHEMBL5506288 0.68 TRPA1 (0.32)
SCHEMBL18941455 0.68 KDM4E (0.31)
SCHEMBL7747639 0.68
SCHEMBL2556533 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8961946-B2 Hair processing agent and method for permanent waving hair SHOWA DENKO K.K. (JP) 2015-02-24 US claimed
US-20080085251-A1 even at a neutral to weakly acidic pH; a lactone or lactam having a mercapto group; with thioglycolic acid, thiolactic acid, cysteine, acetylcysteine, cysteamine, acylcysteamine; RESONAC CORPORATION (JP) 2008-04-10 US claimed
US-20030180241-A1 Deodorant composition for permanent wave TAKASAGO INTERNATIONAL CORPORATION 2003-09-25 US claimed
US-20030180238-A1 Deodorant composition TAKASAGO INTERNATIONAL CORPORATION 2003-09-25 US claimed
EP-1346720-A2 Composition for deodorizing hair dyeing and hair bleaching compositions Takasago International Corporation (JP) 2003-09-24 EP claimed
WO-2020137609-A1 DEODORIZATION COMPOSITION AND DEODORIZATION METHOD, AND OFFENSIVE ODOR-EMITTING PEST CONTROL COMPOSITION AND OFFENSIVE ODOR-EMITTING PEST CONTROL METHOD 大日本除蟲菊株式会社 2020-07-02 WO disclosed
US-10006151-B2 Polyurethane fiber TORAY OPELONTEX CO., LTD. (JP) 2018-06-26 US disclosed
EP-2947185-B1 POLYURETHANE FIBER AND ITS USE TORAY OPELONTEX CO LTD (JP) 2018-02-28 EP disclosed
EP-2907568-B1 A FRAGRANCE-DELIVERY COMPOSITION COMPRISING PERSULFATE ION-CROSSLINKED POLYVINYL ALCOHOL MICROCAPSULES AND METHOD OF USE THEREOF ENCAPSYS LLC (US) 2017-12-06 EP disclosed
US-9358191-B2 Deodorant composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2016-06-07 US disclosed
US-20160002827-A1 POLYURETHANE FIBER TORAY OPELONTEX CO., LTD. (JP) 2016-01-07 US disclosed
EP-2947185-A1 POLYURETHANE FIBER Toray Opelontex Co., Ltd (JP) 2015-11-25 EP disclosed
US-20060035795-A1 Household products TAKASAGO INTERNATIONAL CORPORATION 2006-02-16 US disclosed
EP-1561476-A1 DEODORANT COMPOSITION Takasago International Corporation (JP) 2005-08-10 EP disclosed
US-20030180241-A1 Deodorant composition for permanent wave TAKASAGO INTERNATIONAL CORPORATION 2003-09-25 US disclosed
US-20030180241-A1 Deodorant composition for permanent wave TAKASAGO INTERNATIONAL CORPORATION 2003-09-25 US disclosed
US-20030180238-A1 Deodorant composition TAKASAGO INTERNATIONAL CORPORATION 2003-09-25 US disclosed
US-20030180238-A1 Deodorant composition TAKASAGO INTERNATIONAL CORPORATION 2003-09-25 US disclosed
EP-1346720-A2 Composition for deodorizing hair dyeing and hair bleaching compositions Takasago International Corporation (JP) 2003-09-24 EP disclosed
EP-1346720-A2 Composition for deodorizing hair dyeing and hair bleaching compositions Takasago International Corporation (JP) 2003-09-24 EP disclosed