SCHEMBL23969122

SCHEMBL23969122

N#Cc1cc2c(cc1-c1cccc(F)c1)-c1cc(-c3cccc(F)c3)c(C#N)cc1C2C(C#N)C#N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
GRM5 P41594 1/20 0.37
MAP4K4 O95819 1/20 0.36
CHUK O15111 1/20 0.34
ADORA2B P29275 2/20 0.34
ADORA1 P30542 2/20 0.34
ADORA2A P29274 1/20 0.34
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
SSTR2 P30874 1/20 0.32
SSTR4 P31391 1/20 0.32
SCN9A Q15858 2/20 0.32
HTR1A P08908 1/20 0.32
HTR7 P34969 1/20 0.32
FNTA P49354 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
SCHEMBL23968948 0.84 ALDH1A1 (0.37) KDM4EHPGDNPSR1GABRG2GABRB3
SCHEMBL23968967 0.80
SCHEMBL23968849 0.76
SCHEMBL23968968 0.76
SCHEMBL23969105 0.70 KIF11 (0.41) CYP11B2
SCHEMBL21917668 0.69 GRM5 (0.41) KDM4EHPGDNPSR1RXFP1GRM5
SCHEMBL21917340 0.69 GRM5 (0.41) KDM4EHPGDNPSR1RXFP1GRM5
SCHEMBL21370879 0.69 MAP4K4 (0.32) MAP4K4
SCHEMBL5027382 0.68 GRM5 (0.52) KDM4EHPGDNPSR1RXFP1GRM5
SCHEMBL15832013 0.68 AR (0.47) KDM4EHPGDNPSR1RXFP1GRM5

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 KDM4E 664/4885HPGD 4085/4885NPSR1 4477/4885

“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.