SCHEMBL270219

SCHEMBL270219

Cc1cnc(NC(C)(C)C)nc1Nc1cccc(C)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.43
MAPK3 P27361 1/20 0.43
SYK P43405 1/20 0.43
CCR4 P51679 1/20 0.43
RAPGEF4 Q8WZA2 1/20 0.42
AURKA O14965 2/20 0.41
LRRK2 Q5S007 1/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CCNA2 P20248 3/20 0.39
CDK2 P24941 3/20 0.39
CCNK O75909 2/20 0.39
CCND3 P30281 2/20 0.39
CDK9 P50750 2/20 0.39
CDK6 Q00534 2/20 0.39
NPC1 O15118 1/20 0.39
JAK2 O60674 1/20 0.39
TNF P01375 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL270785 0.86 MAPK3 (0.52) MAPK3SYKAURKACDK9
SCHEMBL17916005 0.84 LRRK2 (0.49) TP53MAPK3SYKRAPGEF4AURKA
SCHEMBL270784 0.84 MAPK3 (0.47) MAPK3SYKAURKA
SCHEMBL270620 0.84 ULK1 (0.54) TP53MAPK3SYKCCR4AURKA
SCHEMBL270504 0.83 MAPK8 (0.47) MAPK3SYKAURKACDK9JAK2
SCHEMBL301971 0.81 TP53 (0.43) TP53SYKRAPGEF4AURKALRRK2
SCHEMBL270260 0.79 AURKA (0.45) TP53MAPK3AURKAMAPTSMN1; SMN2
SCHEMBL12279165 0.79 TP53 (0.49) TP53CCR4RAPGEF4MAPTSMN1; SMN2
SCHEMBL270593 0.79 TTBK1 (0.45) MAPK3SYKAURKACDK2CDK9
SCHEMBL270632 0.79 EGFR (0.47) MAPK3SYKCCR4JAK2

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 12 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
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 TP53 3142/4885MAPK3 152/4885SYK 59/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 TP53 1217/4885MAPK3 122/4885SYK 281/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 TP53 1217/4885MAPK3 122/4885SYK 281/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 TP53 1217/4885MAPK3 122/4885SYK 281/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 TP53 1217/4885MAPK3 122/4885SYK 281/4885
US-20110269721-A1 METHODS OF TREATING THALASSEMIA JAK2, STAT5A, STAT5B TP53 1812/4885MAPK3 1819/4885SYK 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.