SCHEMBL23713858

SCHEMBL23713858

C=Cc1ccc(Oc2ccc(C3(c4ccc5ccccc5c4)c4ccccc4-c4ccc(Br)cc43)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.34
PDK2 Q15119 2/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
OPRK1 P41145 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM1A O60341 2/20 0.33
RCOR1 Q9UKL0 2/20 0.33
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32

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
SCHEMBL22211058 0.91 PDK2 (0.36) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL25456242 0.88 PDK2 (0.37) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL21793198 0.85 PDK2 (0.35) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL26156855 0.85 PDK2 (0.36) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL26547819 0.85 PDK2 (0.36) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL26547851 0.85 ESR1 (0.39) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL20869356 0.84 MEN1 (0.41) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL30082736 0.84 MEN1 (0.41) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL16922975 0.83 CYP2A6 (0.48) CYP2A6PDK2KDM4EMEN1LMNA
SCHEMBL29849821 0.82 MEN1 (0.47) PDK2KDM4EMEN1LMNAMAPT

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-20230354697-A1 Compound, Coating Composition Comprising Same, Organic Light-Emitting Device Using Same, and Manufacturing Method Therefor LG CHEM, LTD. (KR) 2023-11-02 US disclosed
US-20230354697-A1 Compound, Coating Composition Comprising Same, Organic Light-Emitting Device Using Same, and Manufacturing Method Therefor LG CHEM, LTD. (KR) 2023-11-02 US disclosed
WO-2021154041-A1 COMPOUND, COATING COMPOSITION COMPRISING SAME, ORGANIC LIGHT-EMITTING DEVICE USING SAME, AND MANUFACTURING METHOD THEREFOR 주식회사 엘지화학 2021-08-05 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-20230354697-A1 Compound, Coating Composition Comprising Same, Organic Light-Emitting Device Using Same, and Manufacturing Method Therefor NOTUM, SEM1, ORMDL3 CYP2A6 558/4885PDK2 3851/4885KDM4E 1312/4885

“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.