SCHEMBL25853455

SCHEMBL25853455

C=C(C)C(=O)Oc1ccc2c(sc3c(OC)c(OC(=O)C(=C)C)ccc32)c1F

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.31
ABCB11 O95342 1/20 0.31
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30
KMT2A Q03164 1/20 0.30
TUBB1 Q9H4B7 1/20 0.30
STING1 Q86WV6 1/20 0.30

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
SCHEMBL25853784 0.92 ELANE (0.36) ELANEABCB11MEN1USP2MAPT
SCHEMBL25853367 0.90 ELANE (0.36) ELANEKMT2A
SCHEMBL25853530 0.86
SCHEMBL25855455 0.86 ELANE (0.36) ELANEKMT2ATUBB1
SCHEMBL25853665 0.85 KMT2A (0.33) ELANEABCB11MEN1USP2MAPT
SCHEMBL25854860 0.85 ELANE (0.36) ELANEKMT2ATUBB1
SCHEMBL25859851 0.85 ELANE (0.30) ELANE
SCHEMBL25853372 0.84 ELANE (0.33) ELANEKMT2A
SCHEMBL25853849 0.84 AKR1B10 (0.30)
SCHEMBL25853454 0.83 EGFR (0.34) MEN1USP2MAPTALOX15KMT2A

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