SCHEMBL25875986

SCHEMBL25875986

C=C(C)C(=O)OCCCc1ccc(-c2ccc3c(oc4c(OC)c(OC(=O)C(=C)C)ccc43)c2F)cc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.35
MAOB P27338 3/20 0.35
MPL P40238 5/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
NCOA1 Q15788 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
TNKS2 Q9H2K2 1/20 0.30
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
HTT P42858 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL25875379 0.93 MAOA (0.33) MAOAMAOBTNKS2POLBAPEX1
SCHEMBL25876147 0.93 MAOA (0.35) MAOAMAOBCYP1A2CYP3A4CYP2C19
SCHEMBL25875299 0.92 POLB (0.33) MPLPOLBAPEX1HTTTDP1
SCHEMBL25876705 0.91 NR1H2 (0.32) MPL
SCHEMBL25875992 0.90 SMN1; SMN2 (0.34) MAOAMAOBCYP1A2CYP3A4CYP2C19
SCHEMBL25875559 0.89 MPL (0.34) MAOAMAOBMPLPOLBAPEX1
SCHEMBL25876290 0.89 FFAR4 (0.33) MAOAMAOB
SCHEMBL25876286 0.89 NR1H2 (0.33) MAOAMAOB
SCHEMBL25876386 0.87 NR1H3 (0.36) POLBAPEX1HTTTDP1
SCHEMBL25875780 0.86 KMT2A (0.36) MAOAMAOBTNKS2POLBAPEX1

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 2 patents. 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
WO-2023134595-A1 POLYMERIZABLE COMPOUND, COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE 烟台显华科技集团股份有限公司 2023-07-20 WO disclosed