SCHEMBL270643

SCHEMBL270643

Cc1cnc(NC(C)(C)C)nc1Nc1csc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK3 P27361 4/20 0.39
PKM P14618 1/20 0.37
SYK P43405 3/20 0.37
AURKA O14965 2/20 0.37
CCNA2 P20248 3/20 0.36
CDK2 P24941 3/20 0.36
CDK9 P50750 2/20 0.35
CDK7 P50613 1/20 0.35
ULK1 O75385 1/20 0.34
EGFR P00533 1/20 0.34
ITK Q08881 1/20 0.34
MAPK1 P28482 2/20 0.33
LRRK2 Q5S007 1/20 0.33
MAP2K1 Q02750 1/20 0.33
PIK3CA P42336 1/20 0.33
CCNK O75909 1/20 0.33
CCND3 P30281 1/20 0.33
CDK6 Q00534 1/20 0.33

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
SCHEMBL17915932 0.86 LRRK2 (0.40) MAPK3PKMSYKAURKACCNA2
SCHEMBL301101 0.83 PKM (0.37) PKMSYKAURKACCNA2CDK2
SCHEMBL12279035 0.82 PKM (0.42) PKMSYKAURKACCNA2CDK2
SCHEMBL265583 0.80 PKM (0.40) PKMSYKAURKACCNA2CDK2
SCHEMBL270620 0.80 ULK1 (0.54) MAPK3SYKAURKACDK9CDK7
SCHEMBL270190 0.75 EGFR (0.54) SYKAURKACDK2EGFRITK
SCHEMBL270219 0.75 TP53 (0.43) MAPK3SYKAURKACCNA2CDK2
SCHEMBL270468 0.74 EGFR (0.42) MAPK3SYKAURKACDK2ULK1
SCHEMBL270632 0.73 EGFR (0.47) MAPK3SYKEGFRPIK3CA
SCHEMBL270659 0.71 SYK (0.37) MAPK3SYKAURKACDK9CDK7

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-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-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-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 MAPK3 152/4885PKM 2170/4885SYK 59/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 MAPK3 122/4885PKM 1565/4885SYK 281/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 MAPK3 122/4885PKM 1565/4885SYK 281/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 MAPK3 122/4885PKM 1565/4885SYK 281/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 MAPK3 122/4885PKM 1565/4885SYK 281/4885
US-20110269721-A1 METHODS OF TREATING THALASSEMIA JAK2, STAT5A, STAT5B MAPK3 1819/4885PKM 1236/4885SYK 43/4885

“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.