SCHEMBL9017914

SCHEMBL9017914

CCCCCC(O)OC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.50
KMT2A Q03164 3/20 0.50
LTA4H P09960 2/20 0.43
MEN1 O00255 2/20 0.43
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 0.41
HMGCR P04035 1/20 0.39
TRPV1 Q8NER1 2/20 0.38
CYP3A4 P08684 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C8 P10632 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2B6 P20813 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2E1 P05181 1/20 0.37
HTR1A P08908 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2A6 P11509 1/20 0.37

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
SCHEMBL11810553 0.99 GAA (0.49) GAAKMT2ALTA4HMEN1CNR1
SCHEMBL471138 0.90 GAA (0.52) GAAKMT2ALTA4HMEN1CNR1
SCHEMBL8594222 0.88 GAA (0.50) GAAKMT2ALTA4HMEN1CNR1
SCHEMBL8644034 0.88 GAA (0.50) GAAKMT2ALTA4HMEN1CNR1
SCHEMBL5050886 0.88 GAA (0.50) GAAKMT2ALTA4HMEN1CNR1
SCHEMBL27931228 0.88 GAA (0.50) GAAKMT2ALTA4HMEN1CNR1
SCHEMBL424069 0.87 GAA (0.49) GAAKMT2ALTA4HMEN1CNR1
SCHEMBL21616895 0.87 GAA (0.49) GAAKMT2ALTA4HMEN1CNR1
SCHEMBL3350961 0.87 GAA (0.49) GAAKMT2ALTA4HMEN1CNR1
SCHEMBL10413969 0.86 GAA (0.48) GAAKMT2ALTA4HMEN1CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113775950-B Light diffusion composite material for LED, lampshade and light-emitting structure 北京金光明通科技有限公司 2024-08-20 CN claimed
CN-113775950-B Light diffusion composite material for LED, lampshade and light-emitting structure 北京金光明通科技有限公司 2024-08-20 CN disclosed
EP-0538189-B1 Process for the preparation of esters of hydroxyphenyl carboxylic acids CIBA GEIGY AG (CH) 1996-01-10 EP disclosed
EP-0538189-A2 Process for the preparation of esters of hydroxyphenyl carboxylic acids CIBA-GEIGY AG (CH) 1993-04-21 EP disclosed
US-3969530-A 4-Hydroxy-3,5-di-alkyl-phenyl-propionic acid composition suitable as lipid lowering and anti-diabetic agents HOECHST AKTIENGESELLSCHAFT (DT) 1976-07-13 US disclosed