SCHEMBL13638219

SCHEMBL13638219

COc1cc(Nc2nc(Nc3ccc(N4CCOCC4)cc3)ncc2C)ccc1I

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 14/20 0.68
PKMYT1 Q99640 1/20 0.68
PDGFRB P09619 1/20 0.64
PDGFRA P16234 1/20 0.64
IGF1R P08069 1/20 0.56
SYK P43405 1/20 0.55
JAK1 P23458 1/20 0.54
JAK3 P52333 1/20 0.54
CDK1 P06493 1/20 0.53
CDK4 P11802 1/20 0.53
CCNB1 P14635 1/20 0.53
CCND1 P24385 1/20 0.53
CCNE1 P24864 1/20 0.53
CDK2 P24941 1/20 0.53

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
SCHEMBL13637916 0.91 BRD4 (0.69) BRD4PKMYT1PDGFRBPDGFRACDK4
SCHEMBL13638218 0.90 BRD4 (0.84) BRD4
SCHEMBL266448 0.89 BRD4 (0.82) BRD4PKMYT1PDGFRBPDGFRA
SCHEMBL14389893 0.88 BRD4 (0.65) BRD4PKMYT1PDGFRBPDGFRAIGF1R
SCHEMBL30306426 0.81 BRD4 (1.00) BRD4
SCHEMBL17526080 0.81 BRD4 (1.00) BRD4
SCHEMBL12277255 0.81 PDGFRB (0.69) BRD4PKMYT1PDGFRBPDGFRAIGF1R
SCHEMBL23885011 0.81 PKMYT1 (1.00) BRD4PKMYT1PDGFRBPDGFRAIGF1R
SCHEMBL30250183 0.81 PKMYT1 (1.00) BRD4PKMYT1PDGFRBPDGFRAIGF1R
SCHEMBL31163056 0.80 BRD4 (0.76) BRD4PDGFRBPDGFRASYK

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-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases IMPACT BIOMEDICINES, INC. 2009-11-05 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-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 BRD4 142/4885PKMYT1 470/4885PDGFRB 264/4885

“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.