SCHEMBL23969065

SCHEMBL23969065

N#Cc1cc2c(cc1-c1ncc3ccccc3n1)-c1cc(-c3ncc4ccccc4n3)c(C#N)cc1C2C(C#N)C#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.39
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
KMT2A Q03164 1/20 0.33
HIF1A Q16665 1/20 0.33
TSHR P16473 2/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
HBB P68871 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PIK3CD O00329 1/20 0.30
S1PR1 P21453 2/20 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
SCHEMBL23969001 0.80 CYP1A2 (0.35) CYP1A2GAAMAPTMEN1LMNA
SCHEMBL21917703 0.76 CYP1A2 (0.43) CYP1A2GAAKDM4EALDH1A1MAPT
SCHEMBL21917323 0.76 CYP1A2 (0.41) CYP1A2GAAKDM4EALDH1A1MAPT
SCHEMBL23968948 0.74 ALDH1A1 (0.37) CYP1A2GAAKDM4EALDH1A1CYP2C9
SCHEMBL21917097 0.73 CYP1A2 (0.41) CYP1A2GAAKDM4EALDH1A1MAPT
SCHEMBL21917345 0.69 CYP1A2 (0.35) CYP1A2GAAKDM4EALDH1A1
SCHEMBL23969122 0.66 KDM4E (0.39) KDM4EHPGD
SCHEMBL23968968 0.66
SCHEMBL23968849 0.66
SCHEMBL23968967 0.65

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-11165025-B2 Compound and organic electronic element comprising same LG CHEM, LTD. 2021-11-02 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-11165025-B2 Compound and organic electronic element comprising same OR10J3, ESR1, ETV6 CYP1A2 758/4885GAA 2824/4885KDM4E 664/4885

“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.