SCHEMBL645451

SCHEMBL645451

CC=CC(C)(C)C

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
SCHEMBL1652971 1.00
SCHEMBL1760723 1.00
Water SCHEMBL11073371 0.96
Cyclohexane SCHEMBL7105517 0.89
Ethylene Glycol SCHEMBL8077930 0.83 TSHR (0.31)
SCHEMBL11031450 0.80
Phosphoric Acid SCHEMBL5963522 0.80 LMNA (0.36)
Tetrahydrofuran SCHEMBL15013764 0.76 ALDH1A1 (0.42)
SCHEMBL5819577 0.75
SCHEMBL18735903 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4732209-A1 ENVIRONMENTAL ATTRIBUTES FOR OLEFIN COMPOSITIONS BASF SE (DE) 2026-04-29 EP claimed
WO-2024260986-A1 ENVIRONMENTAL ATTRIBUTES FOR OLEFIN COMPOSITIONS BASF SE (DE) 2024-12-26 WO claimed
EP-4225471-A1 METHOD FOR CLEANING A GAS MIXTURE BY ADDING OZONE Hitachi Zosen Inova AG (CH) 2023-08-16 EP claimed
US-11505719-B2 Adhesive composition for absorbent articles THE PROCTER & GAMBLE COMPANY (US) 2022-11-22 US claimed
CN-114940883-B Polyacrylamide adhesive and preparation method thereof 山东诺尔生物科技有限公司 2022-09-23 CN claimed
CN-114940883-A Polyacrylamide adhesive and preparation method thereof 山东诺尔生物科技有限公司 2022-08-26 CN claimed
CN-114634589-A Concrete water-retention viscosity reducer and preparation method thereof 云南森博混凝土外加剂有限公司 2022-06-17 CN claimed
US-11349078-B2 Composition for forming organic light-emitting device and method of preparing organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2022-05-31 US claimed
WO-2022079004-A1 METHOD FOR CLEANING A GAS MIXTURE BY ADDING OZONE HITACHI ZOSEN INOVA AG (CH) 2022-04-21 WO claimed
US-20200259093-A1 COMPOSITION FOR FORMING ORGANIC LIGHT-EMITTING DEVICE AND METHOD OF PREPARING ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2020-08-13 US claimed
EP-2817145-A1 PRESSURE SENSITIVE ADHESIVE SHEET AND METHOD OF PRODUCING THEREOF Dow Corning Taiwan Inc (TW) 2014-12-31 EP claimed
EP-2649161-A2 A METHOD FOR PRODUCTION OF MIDDLE DISTILLATE COMPONENTS FROM GASOLINE COMPONENTS BY OLIGOMERIZATION OF OLEFINS Neste Oil Oyj (FI) 2013-10-16 EP claimed
WO-2013130372-A1 TERPENE DERIVED COMPOUNDS ELEVANCE RENEWABLE SCIENCES, INC. (US) 2013-09-06 WO claimed
WO-2013123619-A1 PRESSURE SENSITIVE ADHESIVE SHEET AND METHOD OF PRODUCING THEREOF DOW CORNING TAIWAN INC. (TW) 2013-08-29 WO claimed
US-20130225462-A1 TERPENE DERIVED COMPOUNDS ELEVANCE RENEWABLE SCIENCES, INC. (US) 2013-08-29 US claimed
WO-2012076758-A2 A METHOD FOR PRODUCTION OF MIDDLE DISTILLATE COMPONENTS FROM GASOLINE COMPONENTS NESTE OIL OYJ (FI) 2012-06-14 WO claimed
EP-0552325-B1 NOVEL NAPHTHALENE COMPOUND AND METHOD OF OBTAINING IT FIRMENICH & CIE (CH) 1995-04-26 EP claimed
US-5396014-A Process for the preparation of 4,4-dimethyl-2-pentene FIRMENICH S.A. (CH) 1995-03-07 US claimed
EP-0552325-A1 NOVEL NAPHTHALENE COMPOUND AND METHOD OF OBTAINING IT. FIRMENICH & CIE (CH) 1993-07-28 EP claimed
WO-1993004023-A1 NOVEL NAPHTHALENE COMPOUND AND METHOD OF OBTAINING IT FIRMENICH S.A. (CH) 1993-03-04 WO claimed