SCHEMBL2163231

SCHEMBL2163231

C=CCC(C=O)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
Ethylene SCHEMBL10526617 0.97 TSHR (0.44)
SCHEMBL25135488 0.83
Ethylene SCHEMBL9659958 0.82 LMNA (0.43)
SCHEMBL1399295 0.80
SCHEMBL20191688 0.80 TSHR (0.34)
SCHEMBL13467623 0.78
SCHEMBL1521681 0.78
SCHEMBL10665318 0.78 GRIK1 (0.32)
SCHEMBL1665615 0.78
SCHEMBL1883787 0.77 TSHR (0.61)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024134671-A1 PREPARATION OF 3-ETHYLBICYCLO[3.2.0]HEPT-3-EN-6-ONE BHISAJ PHARMACEUTICALS PVT LTD (IN) 2024-06-27 WO claimed
EP-1799729-B1 FUNCTIONAL SILOXANES AND THEIR VINYL CO-POLYMERS HONEYWELL INT INC (US) 2012-10-17 EP claimed
CN-101010355-A Functionalized siloxanes and silanes and their vinyl copolymers HONEYWELL INT INC (US) 2007-08-01 CN claimed
EP-1799729-A1 FUNCTIONAL SILOXANES AND SILANES AND THEIR VINYL CO-POLYMERS Honeywell International, Inc. (US) 2007-06-27 EP claimed
WO-2006014328-A1 FUNCTIONAL SILOXANES AND SILANES AND THEIR VINYL CO-POLYMERS HONEYWELL INTERNATIONAL INC. (US) 2006-02-09 WO claimed
EP-1098699-B1 PRODUCTION OF GLYCOL MONOESTER EASTMAN CHEM CO (US) 2003-05-14 EP claimed
JP-2002519274-A 2002-07-02 JP claimed
EP-1098699-A1 BASIC CLAY CATALYST FOR THE PRODUCTION OF GLYCOL MONOESTER EASTMAN CHEMICAL COMPANY (US) 2001-05-16 EP claimed
US-6215020-B1 COMPRISING HEATING IN A REACTION VESSEL AN ALDEHYDE AND A CATALYTIC AMOUNT OF A BASE-MODIFIED CLAY, TO PRODUCE A GLYCOL MONOESTER EASTMAN CHEMICAL COMPANY 2001-04-10 US claimed
WO-2000000282-A1 BASIC CLAY CATALYST FOR THE PRODUCTION OF GLYCOL MONOESTER EASTMAN CHEMICAL COMPANY (US) 2000-01-06 WO claimed
WO-2000000456-A1 PREPARATION OF AN ALDOL USING A BASE-MODIFIED CLAY CATALYST EASTMAN CHEMICAL COMPANY (US) 2000-01-06 WO claimed
US-5227544-A Purity, distillation of butyraldehyde reactant BASF CORPORATION (US) 1993-07-13 US claimed
JP-62178536-A None JP disclosed
JP-62178537-A None JP disclosed
JP-63130551-A None JP disclosed
CN-119775116-A Preparation method of midobulin besylate intermediate compound 南京药坦生物科技有限公司 2025-04-08 CN disclosed
JP-S63130551-A PRODUCTION OF 4-PENTENAL COMPOUND KAWAKEN FINE CHEM CO LTD 1988-06-02 JP disclosed
JP-S62178537-A PRODUCTION OF 5-BROMO-1-PENTANAL COMPOUND OF ACETAL DERIVATIVE THEREOF KAWAKEN FINE CHEM CO LTD 1987-08-05 JP disclosed
JP-S62178536-A PRODUCTION OF 5-BROMO-1-PENTANAL COMPOUND OR ACETAL DERIVATIVE THEREOF KAWAKEN FINE CHEM CO LTD 1987-08-05 JP disclosed
US-4046577-A PHOTOREACTIVE COMPOSITIONS COMPRISING POLYMERS CONTAINING ALKOXYAROMATIC GLYOXY GROUPS THE RICHARDSON COMPANY (US) 1977-09-06 US disclosed