SCHEMBL301184

SCHEMBL301184

CCNc1ncc(C)c(Nc2cccc(C(F)(F)F)c2C)n1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
ULK1 O75385 3/20 0.44
STK17A Q9UEE5 2/20 0.42
PTK2 Q05397 2/20 0.41
LRRK2 Q5S007 7/20 0.41
TAS2R14 Q9NYV8 1/20 0.41
SYK P43405 1/20 0.38
CYP1A2 P05177 2/20 0.38
TSHR P16473 1/20 0.38
HIF1A Q16665 1/20 0.38
CACNA1C Q13936 1/20 0.38
SCN5A Q14524 1/20 0.38

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
SCHEMBL301971 0.85 TP53 (0.43) LRRK2SYK
SCHEMBL270785 0.84 MAPK3 (0.52) DHODHHDAC6ULK1STK17APTK2
SCHEMBL763239 0.82 SYK (0.39) STK17ALRRK2SYKCYP1A2TSHR
SCHEMBL266155 0.80 DHODH (0.50) DHODHHDAC6ULK1PTK2TAS2R14
SCHEMBL10261580 0.78 EGFR (0.45) SYK
SCHEMBL764133 0.78 ULK1 (0.51) ULK1SYK
SCHEMBL764443 0.77 SYK (0.54) SYK
SCHEMBL301912 0.76 CTSC (0.57) SYK
SCHEMBL27380892 0.75 LRRK2 (0.53) ULK1LRRK2CYP1A2
SCHEMBL301485 0.75 AURKA (0.51) DHODHSTK17A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1951684-B1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN INC (US) 2016-07-13 EP 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-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases TARGEGEN, INC. (US) 2009-11-19 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 (5 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 DHODH 1254/4885HDAC6 1379/4885ULK1 549/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 DHODH 673/4885HDAC6 2192/4885ULK1 514/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 DHODH 673/4885HDAC6 2192/4885ULK1 514/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 DHODH 673/4885HDAC6 2192/4885ULK1 514/4885
US-20110269721-A1 METHODS OF TREATING THALASSEMIA JAK2, STAT5A, STAT5B DHODH 307/4885HDAC6 761/4885ULK1 3364/4885

“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.