SCHEMBL25855185

SCHEMBL25855185

C=C(C)C(=O)Oc1ccc(-c2ccc3c(sc4c(C)c(OC(=O)C(=C)C)ccc43)c2C)cc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.40
KMT2A Q03164 4/20 0.38
ATM Q13315 1/20 0.38
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
BACE1 P56817 1/20 0.33
MEN1 O00255 1/20 0.31
ADORA3 P0DMS8 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
SCHEMBL25855045 0.92 ELANE (0.38) ELANEKMT2AATMGAAHTT
SCHEMBL25854855 0.91 ELANE (0.37) ELANEKMT2AATMBACE1
SCHEMBL25855612 0.90 ELANE (0.36) ELANEKMT2AATMGAAHTT
SCHEMBL25855191 0.90 ELANE (0.36) ELANEKMT2AATMGAAHTT
SCHEMBL25856002 0.88 ELANE (0.35) ELANEKMT2AATMBACE1
SCHEMBL25855314 0.88 ELANE (0.35) ELANEKMT2AATMGAAHTT
SCHEMBL25856226 0.86 ELANE (0.34) ELANEKMT2AATMADORA3
SCHEMBL25855322 0.86 ELANE (0.34) ELANEKMT2AATM
SCHEMBL25854449 0.86 ELANE (0.39) ELANEKMT2AATMHTTBACE1
SCHEMBL25853594 0.85 ELANE (0.37) ELANEKMT2AATMGAA

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