SCHEMBL25875784

SCHEMBL25875784

C=C(C)C(=O)OCCCc1ccc(-c2ccc3c(oc4c(C)c(OC(=O)C(=C)C)ccc43)c2C(F)(F)F)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.34
NR1H3 Q13133 2/20 0.34
PPARD Q03181 2/20 0.34
PPARA Q07869 2/20 0.34
KDM4E B2RXH2 4/20 0.32
HPGD P15428 3/20 0.32
KMT2A Q03164 3/20 0.32
GAA P10253 2/20 0.32
LMNA P02545 2/20 0.32
HSD17B10 Q99714 2/20 0.32
GBA1 P04062 1/20 0.32
GLA P06280 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 3/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
NPC1 O15118 1/20 0.31
TSHR P16473 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL25876565 0.94 NR1H3 (0.37) NR1H2NR1H3PPARDPPARAHTT
SCHEMBL25876477 0.93 NR1H3 (0.36) NR1H2NR1H3PPARDPPARAHTT
SCHEMBL25875449 0.91 NR1H2 (0.34) NR1H2NR1H3PPARDPPARAHTT
SCHEMBL25875670 0.90 GBA1 (0.36) KDM4EHPGDKMT2AGAALMNA
SCHEMBL25876286 0.90 NR1H2 (0.33) NR1H2NR1H3MAOAMAOB
SCHEMBL25876798 0.89 NR1H2 (0.33) NR1H2NR1H3
SCHEMBL25875559 0.88 MPL (0.34) NR1H2NR1H3PPARDPPARAKDM4E
SCHEMBL25875840 0.88 KDM4E (0.32) NR1H2NR1H3PPARDPPARAKDM4E
SCHEMBL25876386 0.88 NR1H3 (0.36) NR1H2NR1H3PPARDPPARAHTT
SCHEMBL25874326 0.87 HPGD (0.34) PPARDPPARAKDM4EHPGDKMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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