SCHEMBL21399400

SCHEMBL21399400

CC1(C)OB(c2cccc3c2-c2ccc(C#N)cc2C32c3ccccc3Oc3ccccc32)OC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.34
ABCC9 O60706 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
SCHEMBL22484434 0.92 ABCC9 (0.30) ABCC9
SCHEMBL26626365 0.87 PDK2 (0.35) PDK2
SCHEMBL23257676 0.86 PDK2 (0.34) PDK2
SCHEMBL21517523 0.85 PDK2 (0.37) PDK2
SCHEMBL21701657 0.85 PDK2 (0.35) PDK2
SCHEMBL22484830 0.84 PGR (0.36) PDK2
SCHEMBL15713669 0.84 LPL (0.33)
SCHEMBL30800709 0.84 LPL (0.33)
SCHEMBL21517353 0.84 PDK2 (0.38) PDK2ABCC9
SCHEMBL21343133 0.83 OPRD1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11737358-B2 Compound and organic light emitting device comprising same LG CHEM, LTD. (KR) 2023-08-22 US disclosed
US-11737358-B2 Compound and organic light emitting device comprising same LG CHEM, LTD. (KR) 2023-08-22 US disclosed
US-20200303655-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2020-09-24 US disclosed
WO-2019182402-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2019-09-26 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 (2 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-11737358-B2 Compound and organic light emitting device comprising same ARNT, CYP1A1, AHR PDK2 3544/4885ABCC9 2094/4885
US-20200303655-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME ARNT, CYP1A1, AHR PDK2 3544/4885ABCC9 2094/4885

“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.