SCHEMBL25513451

SCHEMBL25513451

Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cc(C#N)cc(-n2c3ccc(C)cc3c3cc(C)ccc32)c1C#N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
CYP2A6 P11509 1/20 0.38
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
LMNA P02545 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
POLB P06746 2/20 0.34
HIF1A Q16665 2/20 0.34
HTT P42858 1/20 0.34
NCOA1 Q15788 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
THRB P10828 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
KDM4E B2RXH2 2/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
USP14 P54578 1/20 0.31
PDE9A O76083 1/20 0.31
PDE1C Q14123 1/20 0.31
MEN1 O00255 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
SCHEMBL25513395 0.93 BCHE (0.40) ALDH1A1BCHEACHELMNAHIF1A
SCHEMBL21414110 0.91 ALDH1A1 (0.34) ALDH1A1CYP2A6BCHEACHELMNA
SCHEMBL23268023 0.87 LMNA (0.38) ALDH1A1CYP2A6BCHEACHELMNA
SCHEMBL20061235 0.87 ALDH1A1 (0.38) ALDH1A1CYP2A6BCHEACHEKDM4E
SCHEMBL19917582 0.87 ALDH1A1 (0.41) ALDH1A1CYP2A6BCHEACHEUSP14
SCHEMBL21240904 0.85 PDE9A (0.36) ALDH1A1CYP2A6BCHEACHELMNA
SCHEMBL21414257 0.85 PDE9A (0.37) ALDH1A1BCHEACHELMNAHIF1A
SCHEMBL17741545 0.84 ALDH1A1 (0.39) ALDH1A1CYP2A6BCHEACHELMNA
SCHEMBL23263970 0.84 BCHE (0.35) ALDH1A1CYP2A6BCHEACHELMNA
SCHEMBL19809853 0.84 ALDH1A1 (0.42) ALDH1A1CYP2A6BCHEACHEL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230157150-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2023-05-18 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-20230157150-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME OCIAD1, EML4, OCIAD2 ALDH1A1 582/4885CYP2A6 2618/4885BCHE 1251/4885

“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.