SCHEMBL25855191

SCHEMBL25855191

C=C(C)C(=O)Oc1ccc(-c2ccc3c(sc4c(C)c(OC(=O)C(=C)C)ccc43)c2OC)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.36
KMT2A Q03164 4/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
BACE1 P56817 3/20 0.34
ATM Q13315 1/20 0.34
MEN1 O00255 1/20 0.33
TUBB4A P04350 2/20 0.32
TUBB P07437 2/20 0.32
TUBA3C P0DPH7 2/20 0.32
TUBA1B P68363 2/20 0.32
TUBA4A P68366 2/20 0.32
TUBB4B P68371 2/20 0.32
TUBB3 Q13509 2/20 0.32
TUBB2A Q13885 2/20 0.32
TUBB8 Q3ZCM7 2/20 0.32
TUBA3E Q6PEY2 2/20 0.32
TUBA1A Q71U36 2/20 0.32
TUBA1C Q9BQE3 2/20 0.32
TUBB6 Q9BUF5 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
SCHEMBL25855746 0.92 ELANE (0.39) ELANEKMT2ABACE1ATMTUBB4A
SCHEMBL25855612 0.91 ELANE (0.36) ELANEKMT2AGAAHTTBACE1
SCHEMBL25855185 0.90 ELANE (0.40) ELANEKMT2AGAAHTTBACE1
SCHEMBL25854860 0.88 ELANE (0.36) ELANEKMT2ABACE1ATMTUBB4A
SCHEMBL25855322 0.88 ELANE (0.34) ELANEKMT2AATM
SCHEMBL25855045 0.87 ELANE (0.38) ELANEKMT2AGAAHTTBACE1
SCHEMBL25856318 0.85 ABL1 (0.34) ELANEKMT2ABACE1ATMTUBB4A
SCHEMBL25856096 0.85 ELANE (0.34) ELANEKMT2ABACE1ATMTUBB4A
SCHEMBL25853665 0.85 KMT2A (0.33) ELANEKMT2AATMMEN1
SCHEMBL25855455 0.85 ELANE (0.36) ELANEKMT2ABACE1ATMTUBB4A

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