SCHEMBL25876563

SCHEMBL25876563

C=C(C)C(=O)Oc1ccc(-c2ccc3c(oc4c(C(F)(F)F)c(OC(=O)C(=C)C)ccc43)c2C(F)(F)F)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.37
KMT2A Q03164 3/20 0.35
ATM Q13315 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
PPARG P37231 1/20 0.32
NR1H2 P55055 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
NR1H3 Q13133 1/20 0.32
CYP2C9 P11712 1/20 0.32
BACE1 P56817 2/20 0.32
MEN1 O00255 1/20 0.31
ABL1 P00519 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 1/20 0.31
CSF1R P07333 1/20 0.31
LYN P07948 1/20 0.31
KIT P10721 1/20 0.31
SRC P12931 1/20 0.31
FLT1 P17948 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
SCHEMBL25876384 0.93 ELANE (0.35) ELANEKMT2AATMADORA3PPARG
SCHEMBL25875782 0.93 KMT2A (0.38) ELANEKMT2AATMADORA3MEN1
SCHEMBL25875382 0.93 ELANE (0.35) ELANEKMT2AATMADORA3BACE1
SCHEMBL25876472 0.93 KMT2A (0.36) ELANEKMT2AATMADORA3PPARG
SCHEMBL25876151 0.91 ADORA3 (0.36) ELANEKMT2AATMADORA3CYP2C9
SCHEMBL25876482 0.91 ADORA3 (0.34) ELANEKMT2AATMADORA3PPARG
SCHEMBL25876794 0.90 ADORA3 (0.36) ELANEKMT2AATMADORA3ABL1
SCHEMBL25876568 0.90 ADORA3 (0.34) ELANEKMT2AATMADORA3ABL1
SCHEMBL25875212 0.87 ALDH1A1 (0.38) ELANEKMT2AATMPPARGCYP2C9
SCHEMBL25874692 0.87 ELANE (0.34) ELANEKMT2AATMCYP2C9

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-2023134595-A1 POLYMERIZABLE 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-2023134594-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