SCHEMBL271507

SCHEMBL271507

COc1cc(Nc2nc(Nc3ccc(OC4CCCCC4)cc3)ncc2C)ccc1Cl

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 17/20 0.62
BCL6 P41182 1/20 0.51
JAK2 O60674 1/20 0.47
CYP3A4 P08684 1/20 0.47
JAK1 P23458 1/20 0.47
JAK3 P52333 1/20 0.47
EPHA2 P29317 1/20 0.46
KDR P35968 1/20 0.46
EPHB4 P54760 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
SCHEMBL264817 0.91 BRD4 (0.70) BRD4JAK2CYP3A4JAK1JAK3
SCHEMBL270949 0.90 BRD4 (0.49) BRD4
SCHEMBL271306 0.85 JAK2 (0.56) BRD4JAK2CYP3A4JAK1JAK3
SCHEMBL760315 0.85 CDK2 (0.49) BRD4JAK2CYP3A4JAK1JAK3
SCHEMBL271520 0.84 AURKA (0.51) BRD4JAK2JAK1JAK3KDR
SCHEMBL270986 0.83 BRD4 (0.59) BRD4BCL6
SCHEMBL265286 0.82 BRD4 (0.84) BRD4
SCHEMBL271208 0.81 BRD4 (0.63) BRD4
SCHEMBL12109505 0.81 BRD4 (0.65) BRD4JAK2JAK1JAK3EPHA2
SCHEMBL266088 0.80 BRD4 (0.56) BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138199-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-20 US disclosed
US-8133900-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-13 US disclosed
US-20110269721-A1 METHODS OF TREATING THALASSEMIA TARGEGEN, INC. (US) 2011-11-03 US disclosed
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 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 (2 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-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 BRD4 142/4885BCL6 747/4885JAK2 1/4885
US-20110269721-A1 METHODS OF TREATING THALASSEMIA JAK2, STAT5A, STAT5B BRD4 1036/4885BCL6 148/4885JAK2 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.