SCHEMBL21793202

SCHEMBL21793202

CCCCC(CC)COc1ccc(C2(c3ccc(Oc4ccc5c(c4)CC5)cc3)c3ccccc3-c3ccc(Br)cc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PDK2 Q15119 3/20 0.32
LTA4H P09960 1/20 0.30
CA2 P00918 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL21793380 0.91 MEN1 (0.36) MEN1MAPTKMT2AL3MBTL1PDK2
SCHEMBL21793375 0.86 MEN1 (0.39) MEN1MAPTKMT2AL3MBTL1PDK2
SCHEMBL29523937 0.86 MEN1 (0.39) MEN1MAPTKMT2AL3MBTL1PDK2
SCHEMBL21793203 0.86 MEN1 (0.35) MEN1MAPTKMT2AL3MBTL1
SCHEMBL29403730 0.85 MAPK1 (0.38) MEN1MAPTKMT2AL3MBTL1PDK2
SCHEMBL19149291 0.85 MAPK1 (0.38) MEN1MAPTKMT2AL3MBTL1PDK2
SCHEMBL13910177 0.82 PDK2 (0.43) MEN1MAPTKMT2AL3MBTL1PDK2
SCHEMBL21793376 0.82 MEN1 (0.37) MEN1MAPTKMT2AL3MBTL1PDK2
SCHEMBL23713945 0.80 PDK2 (0.39) MEN1MAPTKMT2AL3MBTL1PDK2
SCHEMBL21793629 0.80 PDK2 (0.41) MEN1MAPTKMT2AL3MBTL1PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11472966-B2 Coating composition, organic light-emitting diode using same and method for preparing same LG CHEM, LTD. 2022-10-18 US disclosed
US-11377570-B2 Ink composition for organic light emitting device LG CHEM, LTD. 2022-07-05 US disclosed
US-11274213-B2 Compound, coating composition comprising same, organic light-emitting diode using same, and method for preparing same LG CHEM, LTD. 2022-03-15 US disclosed
US-20200308435-A1 Ink Composition for Organic Light Emitting Device LG CHEM, LTD. (KR) 2020-10-01 US disclosed
US-20200259095-A1 Compound, Coating Composition Comprising Same, Organic Light-Emitting Diode Using Same, and Method for Preparing Same LG CHEM, LTD. (KR) 2020-08-13 US disclosed
WO-2020045904-A1 INK COMPOSITION FOR ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2020-03-05 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 (3 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-20200259095-A1 Compound, Coating Composition Comprising Same, Organic Light-Emitting Diode Using Same, and Method for Preparing Same SEM1, SETDB1, ORMDL3 MEN1 601/4885MAPT 268/4885KMT2A 722/4885
US-11472966-B2 Coating composition, organic light-emitting diode using same and method for preparing same OR10J3, SEM1, ORMDL3 MEN1 1096/4885MAPT 291/4885KMT2A 1418/4885
US-11274213-B2 Compound, coating composition comprising same, organic light-emitting diode using same, and method for preparing same SEM1, SETDB1, ORMDL3 MEN1 601/4885MAPT 268/4885KMT2A 722/4885

“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.