SCHEMBL6283852

SCHEMBL6283852

Cn1ccc(Nc2cccc(-c3ccccc3C#N)c2)c(N)c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ GABRA1 P14867 5/20 0.40
▸ GABRG2 P18507 5/20 0.40
▸ GABRB3 P28472 5/20 0.40
▸ GABRA2 P47869 4/20 0.40
▸ GABRA5 P31644 3/20 0.40
▸ GABRA3 P34903 3/20 0.40
▸ GAA P10253 3/20 0.39
▸ GLA P06280 1/20 0.39
▸ BRD4 O60885 4/20 0.39
▸ ATAD2 Q6PL18 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TTK P33981 1/20 0.36

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
SCHEMBL6286436 0.83 ALDH1A1 (0.39) KDM4EALDH1A1SMN1; SMN2GABRA1GABRG2
SCHEMBL17940714 0.74 KDM4E (0.51) KDM4EALDH1A1SMN1; SMN2GAAMEN1
SCHEMBL29642785 0.74 KDM4E (0.51) KDM4EALDH1A1SMN1; SMN2GAAMEN1
SCHEMBL4004456 0.70 BCL6 (0.39) KDM4EALDH1A1SMN1; SMN2GABRA1GABRG2
SCHEMBL17940697 0.68 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2GAAGLA
SCHEMBL17947267 0.68 NPSR1 (0.46) KDM4ESMN1; SMN2GAAMEN1LMNA
SCHEMBL979345 0.66 IKBKB (0.50) ALDH1A1GABRA1GABRG2GABRB3GABRA2
SCHEMBL6284455 0.66 GABRA1 (0.56) KDM4EALDH1A1SMN1; SMN2GABRA1GABRG2
SCHEMBL6279717 0.65 IDO1 (0.39) KDM4EGAAATAD2MEN1LMNA
Methylamine SCHEMBL3181738 0.65 ESR2 (0.62) KDM4EALDH1A1SMN1; SMN2GABRG2GABRB3

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-6887885-B2 Imidazo[4,5-c]pyridin-4-one analogues as GABAA receptor ligands MERCK SHARP & DOHME LTD 2005-05-03 — — US disclosed
US-20040132767-A1 Imidazo[4,5-c]pyridin-4-one analogues as GABAA receptor ligands MERCK SHARP & DOHME LTD. (GB) 2004-07-08 — — 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-20040132767-A1 Imidazo[4,5-c]pyridin-4-one analogues as GABAA receptor ligands GABRA1, GABRA2, GABRA3 KDM4E 3875/4885ALDH1A1 863/4885SMN1; SMN2 2569/4885

“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.

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