SCHEMBL29440730

SCHEMBL29440730

CCCCc1ccccc1C(O)C(CO)(CO)CO.OP(O)OP(O)O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 9/20 0.38
CYSLTR1 Q9Y271 9/20 0.38
LIPG Q9Y5X9 1/20 0.35
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
PPARA Q07869 1/20 0.33
ALOX5 P09917 1/20 0.32
PTGS2 P35354 1/20 0.32
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL27548049 0.95 CYSLTR2 (0.44) CYSLTR2CYSLTR1LIPGPPARAALOX5
SCHEMBL27354513 0.86 CYSLTR2 (0.50) CYSLTR2CYSLTR1LIPGPPARATHRA
SCHEMBL26115132 0.84 CYSLTR2 (0.36) CYSLTR2CYSLTR1LIPGCYP3A4CYP2D6
SCHEMBL28762329 0.83 S1PR1 (0.35)
SCHEMBL29922311 0.81 CYSLTR2 (0.43) CYSLTR2CYSLTR1LIPGPPARAALOX5
Phosphoric Acid SCHEMBL27456036 0.80 CYSLTR2 (0.48) CYSLTR2CYSLTR1LIPG
SCHEMBL31205620 0.78 ESR1 (0.44) CYP3A4CYP2D6CYP2C9
SCHEMBL29701332 0.78 CYSLTR2 (0.39) CYSLTR2CYSLTR1LIPGPPARAALOX5
SCHEMBL27642505 0.74 ALDH1A1 (0.34)
SCHEMBL28071027 0.73 SKP2 (0.37) PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023080476-A1 FLAME RETARDANT COMPOSITION AND FLAME RETARDANT SYNTHETIC RESIN COMPOSITION CONTAINING METAL PHOSPHINATE-BASED FLAME RETARDANT 이정훈 2023-05-11 WO disclosed
EP-4037900-A1 LED LIGHTING ELEMENT ON THE BASIS OF MULTI-LAYER BODIES HAVING SOLID STONE APPEARANCE Covestro Intellectual Property GmbH & Co. KG (DE) 2022-08-10 EP disclosed
EP-4037899-A1 LED ILLUMINATION ELEMENTS BASED ON MULTI-LAYER ELEMENTS WITH A STONE-LIKE APPEARANCE Covestro Intellectual Property GmbH & Co. KG (DE) 2022-08-10 EP disclosed
EP-3997164-A1 USE OF PHENOLICALLY SUBSTITUTED SUGAR DERIVATIVES AS STABILISERS, PLASTIC COMPOSITION, METHOD FOR STABILISING PLASTICS AND PHENOLICALLY SUBSTITUTED SUGAR DERIVATIVES Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2022-05-18 EP disclosed
WO-2022071051-A1 MALEIMIDE COPOLYMER デンカ株式会社 2022-04-07 WO disclosed
WO-2022071050-A1 PRODUCTION METHOD FOR HEAT-RESISTANT RESIN COMPOSITION デンカ株式会社 2022-04-07 WO disclosed