SCHEMBL25876290

SCHEMBL25876290

C=C(C)C(=O)OCCCc1ccc(-c2ccc3c(oc4c(OC)c(OC(=O)C(=C)C)ccc43)c2OC(F)(F)F)cc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.33
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL25876792 0.97 FFAR4 (0.33) FFAR4MAOAMAOBNR1H2NR1H3
SCHEMBL25876856 0.96 NR1H2 (0.33) FFAR4NR1H2NR1H3ALDH1A1L3MBTL1
SCHEMBL25876147 0.92 MAOA (0.35) MAOAMAOBALDH1A1
SCHEMBL25875840 0.92 KDM4E (0.32) NR1H2NR1H3ALDH1A1
SCHEMBL25875456 0.92 NR1H2 (0.32) NR1H2NR1H3
SCHEMBL25876635 0.91 NR1H3 (0.34) NR1H2NR1H3
SCHEMBL25876705 0.90 NR1H2 (0.32) NR1H2NR1H3
SCHEMBL25876709 0.90 NR1H2 (0.32) NR1H2NR1H3ALDH1A1
SCHEMBL25876286 0.90 NR1H2 (0.33) MAOAMAOBNR1H2NR1H3
SCHEMBL25876798 0.89 NR1H2 (0.33) NR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023134594-A1 NEGATIVE DIELECTRIC ANISOTROPIC LIQUID CRYSTAL COMPOSITION, OPTICAL ANISOTROPIER, AND LIQUID CRYSTAL DISPLAY COMPONENT 烟台显华科技集团股份有限公司 2023-07-20 WO disclosed