SCHEMBL23740609

SCHEMBL23740609

c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc5c(c4)oc4cc(-n6c7cc8ccccc8cc7c7c8ccccc8ccc76)ccc45)n3)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.32
CYP1A2 P05177 1/20 0.32
FYN P06241 1/20 0.32
MAPK3 P27361 1/20 0.32
AHR P35869 1/20 0.32
PAX8 Q06710 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
GP6 Q9HCN6 1/20 0.30
PDE7A Q13946 1/20 0.30
PDE7B Q9NP56 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
SCHEMBL24152207 0.92 ABCG2 (0.33) CYP1A1CYP1A2FYNMAPK3AHR
SCHEMBL24118905 0.92 CYP1A1 (0.34) CYP1A1CYP1A2FYNMAPK3AHR
SCHEMBL23740462 0.92 CYP1A1 (0.34) CYP1A1CYP1A2FYNMAPK3AHR
SCHEMBL24118904 0.91 CYP1A2 (0.34) CYP1A1CYP1A2FYNMAPK3AHR
SCHEMBL23740398 0.91 CYP1A2 (0.34) CYP1A1CYP1A2FYNMAPK3AHR
SCHEMBL24363389 0.91 ABCG2 (0.35) CYP1A1CYP1A2FYNMAPK3AHR
SCHEMBL24152121 0.91 CYP1A2 (0.33) CYP1A1CYP1A2FYNMAPK3AHR
SCHEMBL24363387 0.90 CYP1A1 (0.31) CYP1A1CYP1A2FYNMAPK3AHR
SCHEMBL23740351 0.90 CYP1A2 (0.33) CYP1A1CYP1A2FYNMAPK3AHR
SCHEMBL23740627 0.90 ABCG2 (0.37) CYP1A1CYP1A2FYNMAPK3AHR

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-20210395263-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE COMPRISING SAME, COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT EMITTING DIODE, AND METHOD FOR MANUFACTURING ORGANIC LIGHT EMITTING DIODE LT MATERIALS CO., LTD. (KR) 2021-12-23 US disclosed
EP-3862353-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE COMPRISING SAME, COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT EMITTING DIODE, AND METHOD FOR MANUFACTURING ORGANIC LIGHT EMITTING DIODE LT Materials Co., Ltd. (KR) 2021-08-11 EP 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-20210395263-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE COMPRISING SAME, COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT EMITTING DIODE, AND METHOD FOR MANUFACTURING ORGANIC LIGHT EMITTING DIODE ODC1, AOX1, CYP1B1 CYP1A1 4/4885CYP1A2 16/4885FYN 2481/4885

“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.