SCHEMBL6292890

SCHEMBL6292890

Cc1nnc(-c2ccccc2F)n2nc(OCc3ncnn3C)c(C3CCCCC3)c12

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 20/20 0.56
GABRB3 P28472 20/20 0.56
GABRA3 P34903 20/20 0.56
GABRA1 P14867 5/20 0.54
GABRA2 P47869 3/20 0.54
GABRA5 P31644 2/20 0.54

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
SCHEMBL6298092 0.99 GABRG2 (0.56) GABRG2GABRB3GABRA3GABRA1GABRA2
SCHEMBL2659079 0.89 GABRG2 (0.58) GABRG2GABRB3GABRA3GABRA1GABRA2
SCHEMBL6294045 0.87 GABRG2 (0.72) GABRG2GABRB3GABRA3GABRA1GABRA2
SCHEMBL2658601 0.84 GABRG2 (0.71) GABRG2GABRB3GABRA3GABRA1
SCHEMBL2658938 0.83 GABRG2 (0.62) GABRG2GABRB3GABRA3GABRA1
SCHEMBL340381 0.82 GABRG2 (0.79) GABRG2GABRB3GABRA3GABRA1GABRA2
SCHEMBL6292893 0.81 GABRG2 (0.73) GABRG2GABRB3GABRA3GABRA1
SCHEMBL6769111 0.80 GABRG2 (0.82) GABRG2GABRB3GABRA3GABRA1GABRA2
SCHEMBL6292932 0.78 GABRG2 (0.76) GABRG2GABRB3GABRA3GABRA1
SCHEMBL6292580 0.78 GABRG2 (0.65) GABRG2GABRB3GABRA3GABRA1GABRA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6872720-B2 Pyrazolo-triazine derivatives as ligands for gaba receptors MERCK SHARP & DOHME LTD. 2005-03-29 US claimed
US-20030060467-A1 Pyrazolo-triazine derivatives as ligands for gaba receptors MERCK SHARP & DOHME LTD. (GB) 2003-03-27 US claimed
US-6872720-B2 Pyrazolo-triazine derivatives as ligands for gaba receptors MERCK SHARP & DOHME LTD. 2005-03-29 US disclosed
US-20030060467-A1 Pyrazolo-triazine derivatives as ligands for gaba receptors MERCK SHARP & DOHME LTD. (GB) 2003-03-27 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-20030060467-A1 Pyrazolo-triazine derivatives as ligands for gaba receptors GABRA5, GABRA3, GABRA4 GABRG2 15/4885GABRB3 7/4885GABRA3 2/4885

“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.