SCHEMBL301475

SCHEMBL301475

CCC(C)(C)Nc1ncc(C)c(Nc2cccc(OC)c2)n1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.55
SYK P43405 7/20 0.55
JAK2 O60674 1/20 0.53
HDAC1 Q13547 1/20 0.53
AURKA O14965 1/20 0.48
ULK1 O75385 1/20 0.46
EGFR P00533 5/20 0.46
ITK Q08881 3/20 0.46
JAK3 P52333 1/20 0.46
CDK1 P06493 2/20 0.45
KDM4E B2RXH2 1/20 0.45

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
SCHEMBL270436 0.89 SYK (0.59) BRD4SYKJAK2HDAC1AURKA
SCHEMBL13072638 0.88 SYK (0.58) BRD4SYKJAK2HDAC1EGFR
SCHEMBL305410 0.84 SYK (0.59) BRD4SYKJAK2HDAC1AURKA
SCHEMBL13868406 0.83 EGFR (0.53) BRD4SYKJAK2AURKAEGFR
SCHEMBL17915935 0.82 SYK (0.63) BRD4SYKJAK2HDAC1AURKA
SCHEMBL12111172 0.81 EGFR (0.60) BRD4SYKJAK2HDAC1EGFR
SCHEMBL12320916 0.81 BCL6 (0.47) BRD4JAK2JAK3
SCHEMBL763673 0.80 BRD4 (0.57) BRD4SYKEGFRJAK3CDK1
SCHEMBL10260236 0.78 AURKA (0.52) BRD4SYKJAK2HDAC1AURKA
SCHEMBL14536301 0.78 JAK1 (0.49) BRD4SYKJAK2HDAC1AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133900-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-13 US disclosed
US-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases TARGEGEN, INC. (US) 2009-11-19 US disclosed
US-7528143-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2009-05-05 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-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, LTK BRD4 156/4885SYK 59/4885JAK2 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.