SCHEMBL6129231

SCHEMBL6129231

C[C@@H]1C[C@H](OC(=O)OOC(=O)O[C@H]2C[C@@H](C)CC(C)(C)C2)CC(C)(C)C1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
ALDH1A1 P00352 3/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C9 P11712 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C19 P33261 1/20 0.54
NR1I2 O75469 1/20 0.51
ABCB11 O95342 1/20 0.51
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CTDSP1 Q9GZU7 1/20 0.34
APLNR P35414 1/20 0.33
HTT P42858 1/20 0.33
PPP1CA P62136 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL6129232 1.00 LMNA (0.54) LMNAALDH1A1CYP3A4CYP2C9CYP1A2
SCHEMBL11124584 1.00 LMNA (0.54) LMNAALDH1A1CYP3A4CYP2C9CYP1A2
SCHEMBL9065048 0.93 LMNA (0.50) LMNAALDH1A1CYP3A4CYP2C9CYP1A2
SCHEMBL9065046 0.93 LMNA (0.50) LMNAALDH1A1CYP3A4CYP2C9CYP1A2
SCHEMBL11591288 0.92 ALDH1A1 (0.56) LMNAALDH1A1CYP3A4CYP2C9CYP1A2
SCHEMBL11591282 0.92 ALDH1A1 (0.56) LMNAALDH1A1CYP3A4CYP2C9CYP1A2
SCHEMBL4630600 0.87 LMNA (0.54) LMNAALDH1A1CYP3A4CYP2C9CYP1A2
SCHEMBL4629991 0.87 LMNA (0.54) LMNAALDH1A1CYP3A4CYP2C9CYP1A2
SCHEMBL4629992 0.87 LMNA (0.54) LMNAALDH1A1CYP3A4CYP2C9CYP1A2
SCHEMBL11591693 0.87 LMNA (0.54) LMNAALDH1A1CYP3A4CYP2C9CYP1A2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024028229-A1 METHOD FOR PREPARING A COMPOSITION IN POWDER FORM COMPRISING AT LEAST ONE SOLID ORGANIC PEROXIDE ARKEMA FRANCE (FR) 2024-02-08 WO disclosed
WO-2024023460-A1 COMPOSITION COMPRISING AT LEAST ONE SOLID ORGANIC PEROXIDE ARKEMA FRANCE (FR) 2024-02-01 WO disclosed
WO-2021058926-A1 SOLID ANHYDROUS COMPOSITION IN POWDER FORM COMPRISING AT LEAST ONE ORGANIC PEROXIDE, AT LEAST ONE PHLEGMATIZING AGENT AND AT LEAST ONE BINDER AND CORRESPONDING PREPARATION METHOD ARKEMA FRANCE (FR) 2021-04-01 WO disclosed
US-6846888-B2 Stabilized with a dialkyl maleate; suitable for making polyvinyl chloride for food contact use ATOFINA CHEMICALS, INC. (US) 2005-01-25 US disclosed
EP-1231206-B1 Stabilized organic peroxidicarbonate compositions ATOFINA CHEM INC (US) 2004-03-17 EP disclosed
US-20020177678-A1 Stabilized with a dialkyl maleate; suitable for making polyvinyl chloride for food contact use ATOFINA CHEMICALS, INC. 2002-11-28 US disclosed
EP-1231206-A1 Stabilized organic peroxidicarbonate compositions Atofina Chemicals, Inc. (US) 2002-08-14 EP disclosed
US-6399728-B1 USING UNSATURATED DIESTER ATOFINA CHEMICALS, INC. 2002-06-04 US disclosed
US-5548046-A HOMO OR COPOLYMERIZING ETHYLENICALLY UNSATURATED COMPOUNDS WITH DIALKYL PEROXYCARBONATE CONTAINING NITRILE OR ACETYLENE CONTAINING COMPOUND; THERMAL STABILITY ELF ATOCHEM NORTH AMERICA, INC. (US) 1996-08-20 US disclosed
US-5541151-A ACRYLONITRILES OR VINYLACETYLENES ELF ATOCHEM NORTH AMERICA, INC. (US) 1996-07-30 US disclosed