SCHEMBL25874996

SCHEMBL25874996

C=C(C)C(=O)OCCCc1ccc(-c2ccc3c(oc4cc(OC(=O)C(=C)C)ccc43)c2F)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.34
HTT P42858 2/20 0.34
APEX1 P27695 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 10/20 0.34
LMNA P02545 4/20 0.34
HPGD P15428 4/20 0.34
KDM4E B2RXH2 4/20 0.34
KMT2A Q03164 5/20 0.33
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
MEN1 O00255 4/20 0.33
MAPT P10636 3/20 0.33
MAPK1 P28482 3/20 0.33
TSHR P16473 2/20 0.33
USP2 O75604 1/20 0.33
NOD1 Q9Y239 1/20 0.33
SMN1; SMN2 Q16637 4/20 0.32
BRAF P15056 1/20 0.32
MAP2K1 Q02750 1/20 0.32

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
SCHEMBL25875098 0.91 POLB (0.35) POLBHTTAPEX1TDP1ALDH1A1
SCHEMBL25875214 0.89 PPARA (0.33) POLBHTTAPEX1TDP1ALDH1A1
SCHEMBL25875109 0.89 ALDH1A1 (0.36) POLBHTTAPEX1TDP1ALDH1A1
SCHEMBL25875219 0.87 ESR1 (0.32) POLBHTTAPEX1TDP1ALDH1A1
SCHEMBL25875299 0.86 POLB (0.33) POLBHTTAPEX1TDP1TSHR
SCHEMBL25873717 0.85 POLB (0.38) POLBHTTAPEX1TDP1ALDH1A1
SCHEMBL25874991 0.85 POLB (0.39) POLBHTTAPEX1TDP1ALDH1A1
SCHEMBL25875294 0.84 MMP12 (0.34) POLBHTTAPEX1TDP1TSHR
SCHEMBL25874993 0.84 THRB (0.39) ALDH1A1LMNAHPGDKDM4EKMT2A
SCHEMBL25875559 0.84 MPL (0.34) POLBHTTAPEX1TDP1ALDH1A1

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-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
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