SCHEMBL9065048

SCHEMBL9065048

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

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
NR1I2 O75469 1/20 0.50
ABCB11 O95342 1/20 0.50
ALDH1A1 P00352 3/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
APLNR P35414 1/20 0.33
PPP1CA P62136 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.32
HTT P42858 1/20 0.30

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
SCHEMBL9065046 1.00 LMNA (0.50) LMNANR1I2ABCB11ALDH1A1CYP3A4
SCHEMBL11124584 0.93 LMNA (0.54) LMNANR1I2ABCB11ALDH1A1CYP3A4
SCHEMBL6129231 0.93 LMNA (0.54) LMNANR1I2ABCB11ALDH1A1CYP3A4
SCHEMBL6129232 0.93 LMNA (0.54) LMNANR1I2ABCB11ALDH1A1CYP3A4
SCHEMBL11591282 0.86 ALDH1A1 (0.56) LMNANR1I2ABCB11ALDH1A1CYP3A4
SCHEMBL11591288 0.86 ALDH1A1 (0.56) LMNANR1I2ABCB11ALDH1A1CYP3A4
SCHEMBL11591517 0.84 LMNA (0.56) LMNANR1I2ABCB11ALDH1A1CYP3A4
SCHEMBL11591549 0.84 LMNA (0.56) LMNANR1I2ABCB11ALDH1A1CYP3A4
SCHEMBL11591287 0.84 LMNA (0.56) LMNANR1I2ABCB11ALDH1A1CYP3A4
SCHEMBL11591291 0.84 LMNA (0.56) LMNANR1I2ABCB11ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4565561-A1 METHOD FOR PREPARING A COMPOSITION IN POWDER FORM COMPRISING AT LEAST ONE SOLID ORGANIC PEROXIDE ARKEMA FRANCE (FR) 2025-06-11 EP disclosed
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-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-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