SCHEMBL25874991

SCHEMBL25874991

C=C(C)C(=O)OCCCc1ccc(-c2ccc3c(c2)oc2cc(OC(=O)C(=C)C)ccc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.39
APEX1 P27695 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MMP12 P39900 1/20 0.39
MMP13 P45452 1/20 0.39
ALDH1A1 P00352 6/20 0.35
KDM4E B2RXH2 4/20 0.35
GLA P06280 3/20 0.35
GAA P10253 3/20 0.35
KMT2A Q03164 5/20 0.35
MEN1 O00255 3/20 0.35
MAPK1 P28482 3/20 0.35
MAPT P10636 3/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PKM P14618 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
USP2 O75604 1/20 0.34

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
SCHEMBL25873668 0.91 POLB (0.42) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL25875098 0.86 POLB (0.35) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL25874996 0.85 POLB (0.34) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL12073883 0.85 POLB (0.43) POLBAPEX1HTTTDP1KDM4E
SCHEMBL691351 0.84 POLB (0.49) POLBAPEX1HTTTDP1KMT2A
SCHEMBL17750813 0.84 POLB (0.49) POLBAPEX1HTTTDP1KMT2A
SCHEMBL25875109 0.84 ALDH1A1 (0.36) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL25875552 0.84 KDM4E (0.36) POLBAPEX1HTTTDP1MMP12
SCHEMBL25869086 0.83 POLB (0.39) POLBAPEX1HTTTDP1KMT2A
SCHEMBL25875294 0.83 MMP12 (0.34) POLBAPEX1HTTTDP1MMP12

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