SCHEMBL6316282

SCHEMBL6316282

Nc1onc(-c2ccc(Cl)o2)c1C(=O)NC(Cc1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
CA7 P43166 1/20 0.50
PTGS1 P23219 5/20 0.46
ALDH1A1 P00352 2/20 0.43
HTT P42858 1/20 0.43
NCOA1 Q15788 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
SOAT1 P35610 1/20 0.40
CCR3 P51677 1/20 0.39
TACR3 P29371 2/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL6317577 0.88 ALDH1A1 (0.43) ALDH1A1HTTNCOA1SMN1; SMN2NCOA3
SCHEMBL6323740 0.86 MAPT (0.45) CA1CA2CA4CA7ALDH1A1
SCHEMBL6317479 0.85 CA1 (0.55) CA1CA2CA4CA7PTGS1
SCHEMBL6319309 0.84 ALDH1A1 (0.42) ALDH1A1HTTNCOA1SMN1; SMN2NCOA3
SCHEMBL6323353 0.83 L3MBTL1 (0.53) CA1CA2CA4CA7PTGS1
SCHEMBL6323005 0.81 CA1 (0.51) CA1CA2CA4CA7ALDH1A1
SCHEMBL6321134 0.81 CA1 (0.49) CA1CA2CA4CA7PTGS1
SCHEMBL6323666 0.81 CA1 (0.55) CA1CA2CA4CA7PTGS1
SCHEMBL6315656 0.81 CA1 (0.53) CA1CA2CA4CA7PTGS1
SCHEMBL6314911 0.80 CYP1A2 (0.45) ALDH1A1SMN1; SMN2TACR3MEN1KMT2A

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 5 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
CN-1549714-A Aminoisoxazole derivatives active as kinase inhibitors 2004-11-24 CN 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

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.