SCHEMBL5820404

SCHEMBL5820404

CCOC(=O)c1ncc(N)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.48
GABRG2 P18507 1/20 0.48
GABRB3 P28472 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48
GABRA2 P47869 1/20 0.48
GABRA6 Q16445 1/20 0.48
DPP4 P27487 10/20 0.48
HPGD P15428 2/20 0.44
KDM4E B2RXH2 2/20 0.44
GAA P10253 2/20 0.44
MAPT P10636 1/20 0.44
ALDH1A1 P00352 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B2 P37059 1/20 0.43
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAOA P21397 1/20 0.42
PDGFRB P09619 1/20 0.42

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
SCHEMBL22556887 0.84 KDM4E (0.46) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL17512466 0.83 CYP1A2 (0.46) KDM4EMAPTALDH1A1NPSR1LMNA
SCHEMBL24131085 0.83 CYP1A2 (0.46) KDM4EMAPTALDH1A1NPSR1LMNA
SCHEMBL8318161 0.81 ALDH1A1 (0.50) DPP4KDM4EGAAMAPTALDH1A1
SCHEMBL17986657 0.77 CYP1A2 (0.41) HPGDMAPTALDH1A1LMNACYP1A2
SCHEMBL23146879 0.77 DPP4 (0.40) DPP4KDM4EGAAMAPTALDH1A1
SCHEMBL23905355 0.75 HSD17B2 (0.47) DPP4MAPTHSD17B2LMNACYP1A2
SCHEMBL20918389 0.75 ALDH1A1 (0.39) KDM4EMAPTALDH1A1LMNACYP1A2
SCHEMBL5820421 0.75 HTT (0.44) GABRA1GABRA5GABRA3GABRA2GABRA6
SCHEMBL27393841 0.75 CYP2C9 (0.55) GABRA1GABRG2GABRB3GABRA5GABRA3

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
WO-2006112828-A1 AZAINDOLE DERIVATIVES AS INHIBITORS OF P38 KINASE SCIOS, INC. (US) 2006-10-26 WO disclosed
US-20050288299-A1 Azaindole derivatives as inhibitors of p38 kinase SCIOS INC. 2005-12-29 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-20050288299-A1 Azaindole derivatives as inhibitors of p38 kinase MAPKAPK2, MAPK1, MAPK3 GABRA1 3597/4885GABRG2 4101/4885GABRB3 2819/4885

“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.