SCHEMBL6317636

SCHEMBL6317636

COCC(=O)Nc1onc(-c2cccnc2)c1C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GABRA5 P31644 2/20 0.42
GAA P10253 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
NOTUM Q6P988 1/20 0.41
MKNK1 Q9BUB5 5/20 0.40
MKNK2 Q9HBH9 5/20 0.40
RET P07949 1/20 0.40
CYP2C19 P33261 2/20 0.40
BACE1 P56817 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
HSD17B10 Q99714 2/20 0.38
MAPK1 P28482 1/20 0.38
PSMD14 O00487 1/20 0.38

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
SCHEMBL6315244 0.86 MAPK14 (0.43) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL6317072 0.86 NOTUM (0.55) ALDH1A1KDM4EL3MBTL1GAAPOLB
SCHEMBL6316529 0.84 ALDH1A1 (0.43) ALDH1A1KDM4EL3MBTL1GABRA5GAA
SCHEMBL6317074 0.83 ALDH1A1 (0.48) ALDH1A1KDM4EL3MBTL1GAAMEN1
SCHEMBL6316996 0.80 KMT2A (0.44) ALDH1A1KDM4EL3MBTL1GABRA5GAA
SCHEMBL6315833 0.79 KIT (0.48) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL6318092 0.78 ALDH1A1 (0.42) ALDH1A1KDM4EL3MBTL1GABRA5GAA
SCHEMBL6317627 0.78 NAMPT (0.52) ALDH1A1KDM4EL3MBTL1GAAMEN1
SCHEMBL6317998 0.78 TRPV1 (0.55) ALDH1A1KDM4EL3MBTL1GABRA5MKNK1
SCHEMBL6316499 0.77 ADORA2B (0.52) ALDH1A1KDM4EL3MBTL1GAAMEN1

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 ALDH1A1 4444/4885KDM4E 1382/4885L3MBTL1 4176/4885

“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.