SCHEMBL6317596

SCHEMBL6317596

COc1cccc(CC(=O)Nc2onc(-c3ccsc3)c2C(N)=O)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.53
MAPK8 P45983 1/20 0.52
ROCK1 Q13464 12/20 0.48
PRKACA P17612 11/20 0.48
CYP3A4 P08684 6/20 0.48
ALDH1A1 P00352 1/20 0.48
RAB9A P51151 1/20 0.48
HTT P42858 1/20 0.44
ROCK2 O75116 1/20 0.44
CSNK1D P48730 1/20 0.44
GLS O94925 1/20 0.44

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
SCHEMBL6317129 0.85 MAPK8 (0.57) RXFP1MAPK8ROCK1PRKACACYP3A4
SCHEMBL6315689 0.84 FLT3 (0.48) ALDH1A1RAB9AHTT
SCHEMBL6315833 0.80 KIT (0.48) CYP3A4ALDH1A1RAB9ACSNK1D
SCHEMBL6318012 0.77 MAPK14 (0.51) CYP3A4ALDH1A1RAB9AHTT
SCHEMBL6316808 0.77 SMN1; SMN2 (0.50) RXFP1CYP3A4ALDH1A1RAB9AHTT
SCHEMBL6317801 0.77 RAB9A (0.50) RXFP1ALDH1A1RAB9A
SCHEMBL6317985 0.77 MAPK14 (0.51) MAPK8ROCK1PRKACA
SCHEMBL6317993 0.77 ADORA1 (0.51) ALDH1A1CSNK1D
SCHEMBL6316117 0.76 CSNK1D (0.40) MAPK8ALDH1A1RAB9ACSNK1D
SCHEMBL6318306 0.76 RET (0.44) ALDH1A1RAB9ACSNK1D

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 RXFP1 4558/4885MAPK8 190/4885ROCK1 1457/4885

“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.