SCHEMBL23458596

SCHEMBL23458596

c1ccc(-c2cccc(-c3ccc(N(c4ccccc4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.33
MEN1 O00255 2/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
OPRK1 P41145 1/20 0.33
APAF1 O14727 1/20 0.32
NPC1 O15118 1/20 0.32
THRB P10828 1/20 0.32
XBP1 P17861 1/20 0.32
PTBP1 P26599 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
GALK1 P51570 1/20 0.32
BLM P54132 1/20 0.32
SMAD3 P84022 1/20 0.32
ATM Q13315 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL16858128 0.99 PDK2 (0.33) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL24725602 0.97 KDM4E (0.33) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL21664144 0.97 KDM4E (0.33) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL17903127 0.96 MEN1 (0.38) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL15870752 0.96 PDK2 (0.32) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL21663946 0.96 KDM4E (0.32) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL23846066 0.96 KDM4E (0.33) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL23458601 0.96 KDM4E (0.35) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL16858239 0.96 KDM4E (0.35) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL22151585 0.95 PDK2 (0.33) PDK2MEN1LMNAMAPTKMT2A

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
US-20220399501-A1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEM, LTD. (KR) 2022-12-15 US disclosed
WO-2021107736-A1 ORGANIC LIGHT-EMITTING ELEMENT 주식회사 엘지화학 2021-06-03 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-20220399501-A1 ORGANIC LIGHT-EMITTING ELEMENT CYP1A1, AHR, CYP1B1 PDK2 3749/4885MEN1 1630/4885LMNA 2593/4885

“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.