SCHEMBL25853237

SCHEMBL25853237

C=C(C)C(=O)OCCCc1ccc2c(sc3cc(OC(=O)C(=C)C)ccc32)c1OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TUBB4A P04350 2/20 0.34
TUBB P07437 2/20 0.34
TUBA3C P0DPH7 2/20 0.34
TUBA1B P68363 2/20 0.34
TUBA4A P68366 2/20 0.34
TUBB4B P68371 2/20 0.34
TUBB3 Q13509 2/20 0.34
TUBB2A Q13885 2/20 0.34
TUBB8 Q3ZCM7 2/20 0.34
TUBA3E Q6PEY2 2/20 0.34
TUBA1A Q71U36 2/20 0.34
TUBA1C Q9BQE3 2/20 0.34
TUBB6 Q9BUF5 2/20 0.34
TUBB2B Q9BVA1 2/20 0.34
TUBB1 Q9H4B7 2/20 0.34
KDM4E B2RXH2 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
SCHEMBL25853229 0.89 HTT (0.38) HTTPOLBAPEX1TDP1TSHR
SCHEMBL25853308 0.89 POLB (0.35) HTTPOLBAPEX1TDP1TSHR
SCHEMBL25853139 0.88 POLB (0.38) HTTPOLBAPEX1TDP1TSHR
SCHEMBL25853303 0.85 POLB (0.36) HTTPOLBAPEX1TDP1TSHR
SCHEMBL25854572 0.85 ESR1 (0.36) HTTPOLBAPEX1TDP1TUBB4A
SCHEMBL25853847 0.84 POLB (0.36) HTTPOLBAPEX1TDP1MAPT
SCHEMBL25853235 0.83 TSHR (0.36) HTTTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL25853233 0.82 TUBB4A (0.41) HTTTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL25853667 0.82 POLB (0.34) HTTPOLBAPEX1TDP1MAPT
SCHEMBL25852968 0.81 HTT (0.42) HTTPOLBAPEX1TDP1KDM4E

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