SCHEMBL25875781

SCHEMBL25875781

C=CC(=O)Oc1ccc(-c2ccc3c(oc4c(C)c(OC(=O)C=C)ccc43)c2C(F)(F)F)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.38
GAA P10253 2/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 2/20 0.36
ADORA3 P0DMS8 1/20 0.35
HPGD P15428 4/20 0.35
HSD17B10 Q99714 3/20 0.35
KDM4E B2RXH2 3/20 0.35
LMNA P02545 1/20 0.35
GLA P06280 1/20 0.35
MAPK1 P28482 1/20 0.35
ALDH1A1 P00352 2/20 0.34
THRB P10828 2/20 0.33
GBA1 P04062 1/20 0.33
TYMS P04818 1/20 0.33
HSP90AA1 P07900 1/20 0.32
TSHR P16473 1/20 0.32
POLB P06746 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MAPT P10636 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
SCHEMBL25876388 0.92 KMT2A (0.34) KMT2AGAAHTTMEN1ADORA3
SCHEMBL25876562 0.91 TYMS (0.35) ADORA3THRBTYMS
SCHEMBL25875380 0.88 TYMS (0.33) ADORA3THRBTYMS
SCHEMBL25875664 0.88 KMT2A (0.41) KMT2AGAAHTTMEN1ADORA3
SCHEMBL25876149 0.88 ADORA3 (0.36) KMT2AGAAHTTMEN1ADORA3
SCHEMBL25874321 0.87 HPGD (0.39) KMT2AGAAHPGDHSD17B10KDM4E
SCHEMBL25875553 0.86 KMT2A (0.39) KMT2AGAAHTTMEN1ADORA3
SCHEMBL25875785 0.86 KMT2A (0.36) KMT2AGAAHTTMEN1ADORA3
SCHEMBL25876793 0.86 ADORA3 (0.34) ADORA3THRBTYMS
SCHEMBL25875782 0.85 KMT2A (0.38) KMT2AGAAHTTMEN1ADORA3

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