SCHEMBL6323196

SCHEMBL6323196

Nc1onc(-c2ccc(Cl)o2)c1C(=O)NC1CCCCCC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA4 P22748 1/20 0.55
CA7 P43166 1/20 0.55
KMT2A Q03164 5/20 0.49
NPC1 O15118 12/20 0.45
RAB9A P51151 12/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PTGS1 P23219 2/20 0.43
MEN1 O00255 3/20 0.42
S1PR1 P21453 2/20 0.42
CNR1 P21554 1/20 0.42
MLLT3 P42568 1/20 0.41
MLLT1 Q03111 1/20 0.41
TP53 P04637 1/20 0.41
MDM2 Q00987 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
SCHEMBL6318801 1.00 CA1 (0.55) CA1CA2CA4CA7KMT2A
SCHEMBL6314776 0.99 CA1 (0.56) CA1CA2CA4CA7KMT2A
SCHEMBL6315957 0.97 CA1 (0.56) CA1CA2CA4CA7KMT2A
SCHEMBL6316098 0.86 SMN1; SMN2 (0.53) KMT2ANPC1RAB9AMEN1S1PR1
SCHEMBL6321764 0.86 SMN1; SMN2 (0.53) KMT2ANPC1RAB9AMEN1S1PR1
SCHEMBL6316614 0.86 CA1 (0.51) CA1CA2CA4CA7KMT2A
SCHEMBL6316428 0.85 SMN1; SMN2 (0.51) CA1CA2CA4CA7KMT2A
SCHEMBL6318527 0.85 CA1 (0.52) CA1CA2CA4CA7PTGS1
SCHEMBL6317712 0.84 CA2 (0.53) CA1CA2CA4CA7KMT2A
SCHEMBL6321193 0.84 NPC1 (0.62) KMT2ANPC1RAB9AL3MBTL1MEN1

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 CA1 2406/4885CA2 2764/4885CA4 4029/4885

“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.