SCHEMBL6323394

SCHEMBL6323394

CC(C)C(C)NC(=O)c1c(-c2coc3ccccc23)noc1N

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.37
IKBKE Q14164 1/20 0.36
TBK1 Q9UHD2 1/20 0.36
CA1 P00915 4/20 0.36
CA2 P00918 4/20 0.36
CA4 P22748 4/20 0.36
CA7 P43166 4/20 0.36
GRK2 P25098 1/20 0.35
TACR2 P21452 1/20 0.35
TACR3 P29371 1/20 0.35
MAOB P27338 2/20 0.34
PSMB5 P28074 3/20 0.33
PSMB8 P28062 1/20 0.33
LMNA P02545 2/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL6317875 0.87 L3MBTL1 (0.52) L3MBTL1LMNAALDH1A1KMT2A
SCHEMBL6316505 0.87 RAB9A (0.42) L3MBTL1TACR2TACR3MAOBLMNA
SCHEMBL6323271 0.86 ACACB (0.37) L3MBTL1IKBKETBK1CA1CA2
SCHEMBL6324905 0.86 TAS1R3 (0.42) L3MBTL1IKBKETBK1CA1CA2
SCHEMBL6317238 0.85 L3MBTL1 (0.44) L3MBTL1IKBKETBK1CA1CA2
SCHEMBL6324816 0.85 ALDH1A1 (0.44) L3MBTL1IKBKETBK1CA1CA2
SCHEMBL6323089 0.85 NPC1 (0.44) L3MBTL1PSMB5PSMB8LMNARAB9A
SCHEMBL6316589 0.84 KMT2A (0.43) L3MBTL1IKBKETBK1CA1CA2
SCHEMBL885709 0.84 SMN1; SMN2 (0.35) L3MBTL1IKBKETBK1CA1CA2
SCHEMBL6315860 0.83 L3MBTL1 (0.38) L3MBTL1IKBKETBK1CA1CA2

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
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 L3MBTL1 4176/4885IKBKE 80/4885TBK1 73/4885

“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.