SCHEMBL270630

SCHEMBL270630

Cc1cnc(NC(C)(C)C)nc1Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
STK17A Q9UEE5 4/20 0.56
BRD4 O60885 12/20 0.50
AURKA O14965 1/20 0.48
JAK1 P23458 3/20 0.47
HDAC1 Q13547 2/20 0.47
SYK P43405 1/20 0.47
AXL P30530 1/20 0.45
BRD2 P25440 1/20 0.45
JAK3 P52333 1/20 0.45
BRD3 Q15059 1/20 0.45
BRDT Q58F21 1/20 0.45
STK17B O94768 1/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL270641 0.92 AURKA (0.48) STK17ABRD4AURKAJAK1HDAC1
SCHEMBL270203 0.89 BRD4 (0.49) STK17ABRD4AURKAJAK1HDAC1
SCHEMBL270763 0.87 BRD4 (0.61) BRD4JAK1JAK3
SCHEMBL270779 0.87 BRD4 (0.50) STK17ABRD4AURKAJAK1HDAC1
SCHEMBL300804 0.86 GRM4 (0.43) STK17ABRD4AURKAJAK1HDAC1
SCHEMBL270174 0.86 STK17A (0.43) STK17ABRD4AURKAJAK1HDAC1
SCHEMBL270633 0.85 STK17A (0.55) STK17ABRD4AURKAJAK1HDAC1
SCHEMBL17915926 0.85 STK17A (0.59) STK17ABRD4AURKAJAK1HDAC1
SCHEMBL270775 0.83 SYK (0.55) BRD4AURKAJAK1SYKJAK3
SCHEMBL270597 0.82 SYK (0.47) STK17ABRD4AURKAJAK1HDAC1

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 11 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
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 US disclosed
US-7825246-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2010-11-02 US disclosed
US-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases TARGEGEN, INC. (US) 2009-11-19 US disclosed
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases IMPACT BIOMEDICINES, INC. 2009-11-05 US disclosed
US-7528143-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2009-05-05 US disclosed
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-11-08 US disclosed
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-08-16 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 (6 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 STK17A 291/4885BRD4 156/4885AURKA 745/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 STK17A 243/4885BRD4 142/4885AURKA 75/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 STK17A 243/4885BRD4 142/4885AURKA 75/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 STK17A 243/4885BRD4 142/4885AURKA 75/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 STK17A 243/4885BRD4 142/4885AURKA 75/4885
US-20110269721-A1 METHODS OF TREATING THALASSEMIA JAK2, STAT5A, STAT5B STK17A 139/4885BRD4 1036/4885AURKA 3934/4885

“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.