SCHEMBL270658

SCHEMBL270658

Cc1cnc(NC(C)(C)C)nc1Nc1cccc(S(=O)(=O)N(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 13/20 0.51
JAK3 P52333 12/20 0.51
JAK2 O60674 6/20 0.51
BRD4 O60885 4/20 0.51
RET P07949 3/20 0.51
WEE1 P30291 3/20 0.51
FLT3 P36888 3/20 0.51
ALK Q9UM73 3/20 0.51
BRDT Q58F21 2/20 0.51
BUB1B O60566 1/20 0.51
BRD2 P25440 1/20 0.51
BRD3 Q15059 1/20 0.51
SYK P43405 5/20 0.48
HDAC1 Q13547 3/20 0.48
EGFR P00533 3/20 0.48
BTK Q06187 3/20 0.48
TNNI3K Q59H18 2/20 0.47
TYK2 P29597 3/20 0.47
PLK4 O00444 2/20 0.47
CHEK1 O14757 2/20 0.47

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
SCHEMBL14536301 0.90 JAK1 (0.49) JAK1JAK3JAK2BRD4RET
SCHEMBL270505 0.89 JAK1 (0.50) JAK1JAK3JAK2BRD4RET
SCHEMBL270248 0.88 JAK1 (0.59) JAK1JAK3JAK2BRD4RET
SCHEMBL270596 0.87 JAK3 (0.64) JAK1JAK3JAK2BRD4RET
SCHEMBL270232 0.86 BRD4 (0.66) JAK1JAK3JAK2BRD4RET
SCHEMBL270501 0.86 JAK1 (0.56) JAK1JAK3JAK2BRD4RET
SCHEMBL12111065 0.85 JAK3 (0.49) JAK1JAK3JAK2BRD4RET
SCHEMBL17915957 0.85 BRD4 (0.51) JAK1JAK3JAK2BRD4RET
SCHEMBL270524 0.83 JAK1 (0.53) JAK1JAK3JAK2BRD4RET
SCHEMBL270603 0.83 BRD4 (0.63) JAK1JAK3JAK2BRD4RET

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 15 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-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-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-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-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 JAK1 6/4885JAK3 4/4885JAK2 1/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 JAK1 4/4885JAK3 3/4885JAK2 1/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 JAK1 4/4885JAK3 3/4885JAK2 1/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 JAK1 4/4885JAK3 3/4885JAK2 1/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 JAK1 4/4885JAK3 3/4885JAK2 1/4885
US-20110269721-A1 METHODS OF TREATING THALASSEMIA JAK2, STAT5A, STAT5B JAK1 4/4885JAK3 5/4885JAK2 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.