SCHEMBL32690407

SCHEMBL32690407

CC(C)S(=O)(=O)c1ccccc1Nc1nc(Nc2ccc3c(c2)ncn3C)ncc1Br

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDK7 P50613 1/20 0.54
CDK9 P50750 1/20 0.54
ALK Q9UM73 15/20 0.52
MET P08581 8/20 0.49
ULK1 O75385 1/20 0.47
PTK2 Q05397 3/20 0.47
HDAC1 Q13547 2/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46

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
SCHEMBL31251219 0.90 ALK (0.65) CDK7CDK9ALKULK1
SCHEMBL31251332 0.87 ALK (0.51) CDK7CDK9ALKULK1
SCHEMBL32690391 0.86 ALK (0.53) CDK7CDK9ALKMETULK1
SCHEMBL31251128 0.85 CDK7 (0.54) CDK7CDK9ALKMETULK1
SCHEMBL31251238 0.85 ALK (0.55) CDK7CDK9ALKMETULK1
SCHEMBL31251132 0.84 JAK1 (0.55) CDK7CDK9ALKMETULK1
SCHEMBL30833646 0.83 ALK (0.55) CDK7CDK9ALKMETULK1
SCHEMBL29190577 0.83 ALK (0.55) CDK7CDK9ALKMETULK1
SCHEMBL31251390 0.83 ALK (0.65) CDK7CDK9ALKULK1
SCHEMBL31251186 0.83 CDK7 (0.52) CDK7CDK9ALKMETULK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260085050-A1 TRIPLE KINASE INHIBITORS UNOGEN BIOTECH LTD (US) 2026-03-26 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-20260085050-A1 TRIPLE KINASE INHIBITORS ALK, ERBB2, ERBB3 CDK7 159/4885CDK9 96/4885ALK 1/4885

“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.