SCHEMBL6322162

SCHEMBL6322162

COc1ccc(-c2noc(N)c2C(=O)NCC2CCCCC2)cn1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 6/20 0.49
GABRA5 P31644 8/20 0.45
CNR1 P21554 1/20 0.44
GSK3B P49841 2/20 0.43
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL6317339 0.95 GABRA1 (0.53) GABRA1GABRA5GSK3BNPSR1
SCHEMBL6315975 0.85 GABRA1 (0.51) GABRA1GABRA5CNR1
SCHEMBL6324481 0.85 GABRA1 (0.51) GABRA1GABRA5CNR1
SCHEMBL6324294 0.84 GABRA1 (0.51) GABRA1GABRA5CNR1
SCHEMBL6315841 0.82 GABRA1 (0.51) GABRA1GABRA5CNR1
SCHEMBL6323900 0.81 GABRA1 (0.51) GABRA1GABRA5GSK3B
SCHEMBL6316205 0.81 TAS1R3 (0.45) GABRA1
SCHEMBL6322066 0.80 GABRA5 (0.50) GABRA5CNR1GSK3BNPSR1
SCHEMBL6315289 0.80 RAB9A (0.46) GABRA1GABRA5
SCHEMBL6316178 0.79 GABRA1 (0.47) GABRA1GABRA5CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US claimed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP claimed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO claimed
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US disclosed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP disclosed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO 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-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors MAP3K9, MAP3K19, MAP4K2 GABRA1 886/4885GABRA5 742/4885CNR1 3793/4885

“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.