SCHEMBL6319264

SCHEMBL6319264

NC(=O)c1c(-c2ccncc2)noc1NC(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.47
STAT3 P40763 1/20 0.46
STAT1 P42224 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
MLYCD O95822 2/20 0.45
TRPV1 Q8NER1 6/20 0.44
FLT1 P17948 1/20 0.43
KDR P35968 1/20 0.43
PTGS1 P23219 3/20 0.43
MAPK14 Q16539 2/20 0.42
NTRK1 P04629 1/20 0.42
CES1 P23141 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
SCHEMBL6319348 0.89 MAPK14 (0.54) NPC1MAPK14
SCHEMBL6321264 0.89 LMNA (0.55) TRPV1FLT1KDRPTGS1
SCHEMBL6315763 0.88 ABL1 (0.49) HDAC4HDAC6TRPV1FLT1KDR
SCHEMBL6318236 0.88 NTRK1 (0.53) NPC1HDAC4HDAC6TRPV1NTRK1
SCHEMBL6317602 0.87 KMT2A (0.51) NPC1STAT3STAT1KDR
SCHEMBL6318347 0.87 IKBKE (0.54) TRPV1MAPK14
SCHEMBL6319728 0.86 TBK1 (0.52) STAT3KDRMAPK14
SCHEMBL6316062 0.86 NPC1 (0.41) NPC1STAT3STAT1KDRPTGS1
SCHEMBL6317649 0.86 SMN1; SMN2 (0.54) NPC1STAT3HDAC6FLT1KDR
SCHEMBL6314982 0.84 TBK1 (0.43) NPC1

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 NPC1 3741/4885STAT3 300/4885STAT1 204/4885

“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.