SCHEMBL25875670

SCHEMBL25875670

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.36
KDM4E B2RXH2 7/20 0.35
HPGD P15428 6/20 0.35
ALDH1A1 P00352 5/20 0.35
MAPT P10636 4/20 0.35
HTT P42858 3/20 0.35
KMT2A Q03164 3/20 0.35
GAA P10253 2/20 0.35
HSD17B10 Q99714 3/20 0.34
TSHR P16473 3/20 0.34
LMNA P02545 2/20 0.34
GLA P06280 1/20 0.34
MAPK1 P28482 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAOA P21397 3/20 0.33
MAOB P27338 3/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33

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
SCHEMBL25875559 0.92 MPL (0.34) GBA1KDM4EHPGDALDH1A1MAPT
SCHEMBL25875375 0.92 MPL (0.32) GBA1KDM4EHPGDALDH1A1MAPT
SCHEMBL25875992 0.92 SMN1; SMN2 (0.34) KDM4EHPGDALDH1A1MAPTHTT
SCHEMBL25875780 0.92 KMT2A (0.36) GBA1KDM4EHPGDALDH1A1MAPT
SCHEMBL25875784 0.90 NR1H2 (0.34) GBA1KDM4EHPGDALDH1A1MAPT
SCHEMBL25876477 0.90 NR1H3 (0.36) HTTPOLBAPEX1TDP1
SCHEMBL25876709 0.88 NR1H2 (0.32) KDM4EHPGDALDH1A1MAPTHSD17B10
SCHEMBL25875840 0.88 KDM4E (0.32) GBA1KDM4EHPGDALDH1A1MAPT
SCHEMBL25875098 0.87 POLB (0.35) KDM4EHPGDALDH1A1MAPTHTT
SCHEMBL25875552 0.86 KDM4E (0.36) GBA1KDM4EHPGDALDH1A1MAPT

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