SCHEMBL25855454

SCHEMBL25855454

C=CC(=O)Oc1ccc(-c2ccc3c(sc4c(OC)c(OC(=O)C=C)ccc43)c2F)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.34
ADORA3 P0DMS8 1/20 0.32
BACE1 P56817 1/20 0.32
TUBB4A P04350 3/20 0.32
TUBB P07437 3/20 0.32
TUBA3C P0DPH7 3/20 0.32
TUBA1B P68363 3/20 0.32
TUBA4A P68366 3/20 0.32
TUBB4B P68371 3/20 0.32
TUBB3 Q13509 3/20 0.32
TUBB2A Q13885 3/20 0.32
TUBB8 Q3ZCM7 3/20 0.32
TUBA3E Q6PEY2 3/20 0.32
TUBA1A Q71U36 3/20 0.32
TUBA1C Q9BQE3 3/20 0.32
TUBB6 Q9BUF5 3/20 0.32
TUBB2B Q9BVA1 3/20 0.32
TUBB1 Q9H4B7 3/20 0.32
TYMS P04818 1/20 0.32
ESR1 P03372 2/20 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
SCHEMBL25854859 0.93 THRB (0.34) THRBBACE1TUBB4ATUBBTUBA3C
SCHEMBL25855617 0.92 THRB (0.36) THRBADORA3BACE1TUBB4ATUBB
SCHEMBL25855609 0.89 THRB (0.34) THRBADORA3BACE1TUBB4ATUBB
SCHEMBL25854771 0.89 THRB (0.36) THRBTYMSESR1PDE6D
SCHEMBL25855750 0.88 PTGDR2 (0.32) THRBADORA3BACE1TUBB4ATUBB
SCHEMBL25853454 0.87 EGFR (0.34) THRBTYMSEGFR
SCHEMBL25856165 0.87 FFAR4 (0.32) THRBTYMSESR1
SCHEMBL25855044 0.87 THRB (0.36) THRBTYMSPDE6D
SCHEMBL25855189 0.85 KMT2A (0.35) THRBADORA3BACE1TUBB4ATUBB
SCHEMBL25853782 0.85 TYMS (0.37) THRBTYMSEGFR

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-2023134598-A1 POLYMERISABLE 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-2023134596-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