SCHEMBL517343

SCHEMBL517343

CC(C)(C)C1[CH]CCC(C(C)(C)C)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
SCHEMBL4076041 0.76 SLC18A3 (0.32)
SCHEMBL4232041 0.76
SCHEMBL2454745 0.69
SCHEMBL375854 0.67
SCHEMBL864330 0.67
SCHEMBL24234606 0.67 EPHX1 (0.34)
SCHEMBL43311 0.66 EPHX1 (0.31)
SCHEMBL211939 0.65
SCHEMBL1191684 0.64
SCHEMBL11876654 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020065401-A1 Novel compounds for mass colouration of high temperature polymers FEILER LEONHARD (DE) 2002-05-30 US claimed
US-6355783-B1 ESTERIFIED DERIVATIVES OF QUINACRIDONE, ANTHRAQUINONE, PERYLENE, INDIGO, QUINOPHTHALONE, INDANTHRONE, ISOINDOLE, DIOXAZINE, AZO, PHTHALOCYANINE OR DIKETOPYRROLOPYRROLE DYES CIBA SPECIALTY CHEMICALS CORPORATION 2002-03-12 US claimed
EP-0305190-B1 Arylenedoamino substituted triazine UNIROYAL CHEM CO INC (US) 1994-03-30 EP claimed
US-5047530-A Ozone resistance UNIROYAL CHEMICAL COMPANY, INC. (US) 1991-09-10 US claimed
CN-1050871-A The triazine that the arylidene diamino replaces UNIROYAL CHEM CO INC (US) 1991-04-24 CN claimed
US-4972010-A OXIDATION RESISTANCE FOR TIRES, RUBBERS UNIROYAL CHEMICAL COMPANY, INC. (US) 1990-11-20 US claimed
EP-0365127-A1 Substituted triazines UNIROYAL CHEMICAL COMPANY, Inc. (US) 1990-04-25 EP claimed
EP-0343806-A2 Stabilised fat compositions UNIROYAL CHEMICAL COMPANY, Inc. (US) 1989-11-29 EP claimed
US-4839188-A TRIS(N-ALKYL-P-PHENYLENE DIAMINO)-1,3,5-TRIAZINES UNIROYAL CHEMICAL COMPANY, INC. (US) 1989-06-13 US claimed
EP-0305190-A2 Arylenedoamino substituted triazine UNIROYAL CHEMICAL COMPANY, Inc. (US) 1989-03-01 EP claimed
EP-4277591-A1 ETHER COMPOUNDS AS VOLATILES FOR THE TREATMENT OF AMINO ACID BASED SUBSTRATES, SUCH AS SKIN AND HAIR Momentive Performance Materials GmbH (DE) 2023-11-22 EP disclosed
CN-116670108-A Ether compounds as volatiles for treating amino acid based substrates such as skin and hair 迈图高新材料有限责任公司 2023-08-29 CN disclosed
WO-2022152742-A1 ETHER COMPOUNDS AS VOLATILES FOR THE TREATMENT OF AMINO ACID BASED SUBSTRATES, SUCH AS SKIN AND HAIR MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) 2022-07-21 WO disclosed
EP-2392458-B1 POLYPROPYLENE RESIN MOLDED ARTICLE NEW JAPAN CHEM CO LTD (JP) 2018-03-14 EP disclosed
CN-102300709-B Polypropylene-based resin molded article NEW JAPAN CHEMICAL CO.,LTD. (JP) 2016-05-04 CN disclosed
US-20050186518-A1 SILVER-FREE BLACK-AND-WHITE THERMOGRAPHIC MATERIALS CONTAINING A BENZOQUINONE AND METHODS OF IMAGING EASTMAN KODAK COMPANY 2005-08-25 US disclosed
US-20050186520-A1 SILVER-FREE BLACK-AND-WHITE THERMOGRAPHIC MATERIALS EASTMAN KODAK COMPANY 2005-08-25 US disclosed
US-6762224-B2 SOLUBLE PIGMENT PRECURSORS HAVING HIGHER THERMAL STABILITY CIBA SPECIALTY CHEMICALS CORPORATION 2004-07-13 US disclosed
US-6355783-B1 ESTERIFIED DERIVATIVES OF QUINACRIDONE, ANTHRAQUINONE, PERYLENE, INDIGO, QUINOPHTHALONE, INDANTHRONE, ISOINDOLE, DIOXAZINE, AZO, PHTHALOCYANINE OR DIKETOPYRROLOPYRROLE DYES CIBA SPECIALTY CHEMICALS CORPORATION 2002-03-12 US disclosed
EP-1086984-A2 Compounds for mass colouration of polymers Ciba SC Holding AG (CH) 2001-03-28 EP disclosed