SCHEMBL21701686

SCHEMBL21701686

N#Cc1ccccc1-c1cccc2c1-c1c(-c3nc(-c4ccccc4)nc(-c4ccc5ccccc5c4)n3)cccc1C21c2ccccc2Oc2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
ABL1 P00519 1/20 0.32
TRPA1 O75762 1/20 0.32
PIM1 P11309 2/20 0.32
HTT P42858 1/20 0.32
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
FASN P49327 1/20 0.31
PDE9A O76083 1/20 0.31

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
SCHEMBL21701963 0.91 PIM1 (0.37) KDM4EMEN1ALDH1A1TP53CYP1A2
SCHEMBL21702143 0.89 ESR2 (0.35) MEN1CYP1A2KMT2AADORA2AADORA1
SCHEMBL21701897 0.86 ADORA2A (0.33) KDM4EMEN1ALDH1A1TP53CYP1A2
SCHEMBL24905198 0.86 TRPA1 (0.38) KDM4EMEN1ALDH1A1TP53CYP1A2
SCHEMBL21658350 0.86 KDM4E (0.39) KDM4EMEN1ALDH1A1TP53CYP1A2
SCHEMBL21701964 0.85 GABRG2 (0.37) KDM4EMEN1ALDH1A1KMT2AADORA2A
SCHEMBL21658351 0.85 KDM4E (0.38) KDM4EMEN1ALDH1A1TP53CYP1A2
SCHEMBL23965054 0.85 KDM4E (0.38) KDM4EMEN1ALDH1A1TP53CYP1A2
SCHEMBL24905506 0.84 HTT (0.33) KDM4EMEN1ALDH1A1CYP1A2KMT2A
SCHEMBL24905416 0.84 PDK2 (0.34) MEN1ALDH1A1CYP1A2KMT2AHSD17B10

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-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed
US-20220376178-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2022-11-24 US disclosed
US-20200048230-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT INCLUDING SAME LG CHEM, LTD. (KR) 2020-02-13 US 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-20200048230-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT INCLUDING SAME CRY1, CRY2, CYP1A1 KDM4E 2566/4885MEN1 319/4885ALDH1A1 18/4885

“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.