SCHEMBL25875101

SCHEMBL25875101

C=CC(=O)Oc1ccc(-c2ccc3c(oc4cc(OC(=O)C=C)ccc43)c2OC)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.40
KMT2A Q03164 6/20 0.40
KDM4E B2RXH2 5/20 0.40
HTT P42858 1/20 0.40
ALDH1A1 P00352 7/20 0.39
MAPT P10636 5/20 0.39
MEN1 O00255 4/20 0.39
LMNA P02545 3/20 0.39
MAPK1 P28482 2/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
TSHR P16473 1/20 0.39
RECQL P46063 1/20 0.39
NOD2 Q9HC29 1/20 0.38
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38
TUBA4A P68366 1/20 0.38
TUBB4B P68371 1/20 0.38

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
SCHEMBL25874998 0.87 ALDH1A1 (0.40) HPGDKMT2AKDM4EHTTALDH1A1
SCHEMBL25875107 0.87 THRB (0.40) HPGDKMT2AKDM4EHTTALDH1A1
SCHEMBL25875215 0.86 KMT2A (0.34) HPGDKMT2AKDM4EHTTALDH1A1
SCHEMBL25875104 0.85 ALDH1A1 (0.40) HPGDKMT2AKDM4EHTTALDH1A1
SCHEMBL25876143 0.85 ADORA3 (0.41) KMT2AKDM4EHTTALDH1A1MAPT
SCHEMBL25873728 0.85 TUBB4A (0.42) KMT2AKDM4EALDH1A1MAPTMEN1
SCHEMBL25875842 0.83 ABCG2 (0.38) KDM4EALDH1A1TUBB4ATUBBTUBA3C
SCHEMBL25875671 0.82 KMT2A (0.43) HPGDKMT2AKDM4EHTTALDH1A1
SCHEMBL25875376 0.81 ADORA3 (0.36) HPGDKMT2AKDM4EHTTALDH1A1
SCHEMBL25875111 0.81 CYP2C9 (0.36) HPGDKMT2AKDM4EHTTALDH1A1

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