SCHEMBL22326304

SCHEMBL22326304

COC(=O)Cc1cccc(OCCCCCCCC(=O)OC(C)(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 2/20 0.48
HDAC8 Q9BY41 1/20 0.45
CNR1 P21554 3/20 0.44
CNR2 P34972 3/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
GGPS1 O95749 2/20 0.43
HDAC1 Q13547 3/20 0.42
HDAC6 Q9UBN7 1/20 0.42
POLB P06746 1/20 0.41
HDAC2 Q92769 2/20 0.41
CYP2D6 P10635 1/20 0.41

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
SCHEMBL30696861 0.89 PLA2G4B (0.61) PLA2G4BHDAC8GGPS1HDAC1HDAC2
SCHEMBL22326323 0.85 PLA2G4B (0.55) PLA2G4BHDAC8CNR1CNR2KDM4E
SCHEMBL31457831 0.84 PLA2G4B (0.51) PLA2G4BKDM4EALDH1A1GAAGGPS1
SCHEMBL14987498 0.84 SLC7A5 (0.45) PLA2G4BALDH1A1GAAPOLB
SCHEMBL25082081 0.83 PLA2G4B (0.48) PLA2G4BKDM4EGGPS1POLB
SCHEMBL30278822 0.83 PLA2G4B (0.48) PLA2G4BKDM4EGGPS1POLB
SCHEMBL31457778 0.83 PLA2G4B (0.50) PLA2G4BKDM4EALDH1A1GAAGGPS1
SCHEMBL22326247 0.82 KDM4E (0.43) PLA2G4BKDM4EALDH1A1GAAPOLB
SCHEMBL3980344 0.82 CA12 (0.52) KDM4EALDH1A1GAA
SCHEMBL9402581 0.82 PLA2G4B (0.64) PLA2G4BCNR1CNR2GGPS1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220105188-A1 TARGET PROTEIN EED DEGRADATION-INDUCING DEGRADUCER, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING DISEASES RELATED TO EED, EZH2, OR PRC2, COMPRISING SAME AS ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2022-04-07 US disclosed
EP-3922632-A1 TARGET PROTEIN EED DEGRADATION-INDUCING DEGRADUCER, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING DISEASES RELATED TO EED, EZH2, OR PRC2, COMPRISING SAME AS ACTIVE INGREDIENT Korea Research Institute of Chemical Technology (KR) 2021-12-15 EP disclosed
WO-2020162725-A1 TARGET PROTEIN EED DEGRADATION-INDUCING DEGRADUCER, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING DISEASES RELATED TO EED, EZH2, OR PRC2, COMPRISING SAME AS ACTIVE INGREDIENT 한국화학연구원 2020-08-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220105188-A1 TARGET PROTEIN EED DEGRADATION-INDUCING DEGRADUCER, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING DISEASES RELATED TO EED, EZH2, OR PRC2, COMPRISING SAME AS ACTIVE INGREDIENT EED, VHL, CUL1 PLA2G4B 3549/4885HDAC8 1435/4885CNR1 4268/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.