SCHEMBL3944309

SCHEMBL3944309

CC(C)(C)OC(=O)Nc1nc2cc(N)ccc2s1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.67
LCK P06239 11/20 0.53
CRBN Q96SW2 1/20 0.48
DYRK1A Q13627 6/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL3943412 0.90 LCK (0.61) CLK1LCKCRBNNPC1RAB9A
SCHEMBL30263005 0.90 LCK (0.61) CLK1LCKCRBNNPC1RAB9A
SCHEMBL31119647 0.86 DYRK1A (0.67) CLK1LCKCRBNDYRK1ANPC1
SCHEMBL18645938 0.85 DYRK1A (0.67) LCKCRBNDYRK1ANPC1RAB9A
SCHEMBL21496430 0.84 LCK (0.57) LCKCRBNDYRK1ANPC1RAB9A
SCHEMBL6643291 0.81 NPC1 (0.67) LCKDYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL3953825 0.81 ACP1 (0.60) LCKDYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL31395897 0.80 LCK (0.54) CLK1LCKNPC1RAB9ASMN1; SMN2
SCHEMBL20678945 0.79 CLK1 (0.76) CLK1DYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL17090573 0.78 LCK (0.69) LCKDYRK1ANPC1RAB9ASMN1; SMN2

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-7514460-B2 Benzazole analogues and uses thereof 4SC AG (DE) 2009-04-07 US disclosed
EP-1885719-A1 2,5- AND 2,6-DISUBSTITUTED BENZAZOLE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS 4SC AG (DE) 2008-02-13 EP disclosed
WO-2006066795-A1 2,5- AND 2,6-DISUBSTITUTED BENZAZOLE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS 4SC AG (DE) 2006-06-29 WO disclosed
EP-1674467-A1 2,5- and 2,6-disubstituted benzazole derivatives useful as protein kinase inhibitors 4SC AG (DE) 2006-06-28 EP disclosed
US-20060135782-A1 Benzazole analogues and uses thereof 4SC AG (DE) 2006-06-22 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-20060135782-A1 Benzazole analogues and uses thereof DCK, SBK3, DAPK3 CLK1 365/4885LCK 325/4885CRBN 1204/4885

“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.