SCHEMBL25854662

SCHEMBL25854662

C=C(C)C(=O)Oc1ccc(-c2ccc3c(sc4cc(OC(=O)C(=C)C)ccc43)c2C(F)(F)F)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.36
KMT2A Q03164 2/20 0.34
ATM Q13315 1/20 0.34
ESR1 P03372 2/20 0.32
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 1/20 0.31
TUBB4B P68371 1/20 0.31
TUBB3 Q13509 1/20 0.31
TUBB2A Q13885 1/20 0.31
TUBB8 Q3ZCM7 1/20 0.31
TUBA3E Q6PEY2 1/20 0.31
TUBA1A Q71U36 1/20 0.31
TUBA1C Q9BQE3 1/20 0.31
TUBB6 Q9BUF5 1/20 0.31
TUBB2B Q9BVA1 1/20 0.31
TUBB1 Q9H4B7 1/20 0.31
BACE1 P56817 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
SCHEMBL25854665 0.87 POLB (0.33) ESR1
SCHEMBL25856101 0.87 ELANE (0.37) ELANEKMT2AATMBACE1
SCHEMBL25854439 0.87 ELANE (0.39) ELANEKMT2AATMESR1TUBB4A
SCHEMBL25853240 0.87 ELANE (0.36) ELANEKMT2AATMTUBB4ATUBB
SCHEMBL25854668 0.85 ELANE (0.34) ELANEKMT2AATMESR1TUBB4A
SCHEMBL25855862 0.85 KMT2A (0.36) ELANEKMT2AATMESR1
SCHEMBL25854576 0.85 ESR1 (0.33) ESR1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL25854449 0.84 ELANE (0.39) ELANEKMT2AATMTUBB4ATUBB
SCHEMBL25855314 0.84 ELANE (0.35) ELANEKMT2AATMBACE1
SCHEMBL25854941 0.84 ELANE (0.35) ELANEKMT2AATMBACE1

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