SCHEMBL764527

SCHEMBL764527

CCNc1ncc(C)c(Nc2ccc3[nH]ccc3c2)n1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.60
ULK1 O75385 3/20 0.50
SYK P43405 6/20 0.48
WEE1 P30291 1/20 0.46
ALK Q9UM73 1/20 0.46
FGFR2 P21802 1/20 0.44
FLT3 P36888 1/20 0.44
AURKA O14965 1/20 0.44
CACNA2D1 P54289 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
SCHEMBL270667 0.83 EGFR (0.60) EGFRULK1SYKFGFR2FLT3
SCHEMBL301785 0.78 AURKA (0.57) EGFRSYKAURKA
SCHEMBL10260237 0.78 BCL6 (0.55) EGFRSYKAURKA
SCHEMBL303236 0.78 STK17A (0.62) SYKAURKA
SCHEMBL19654392 0.77 ULK1 (0.72) EGFRULK1SYKFLT3
SCHEMBL303133 0.76 SYK (0.49) EGFRSYKAURKA
SCHEMBL301343 0.76 AURKA (0.44) EGFRSYKWEE1ALKAURKA
SCHEMBL10259353 0.76 STK17A (0.62) SYKAURKA
SCHEMBL24625518 0.76 EGFR (1.00) EGFR
SCHEMBL14364688 0.76 EGFR (0.62) EGFRULK1SYKWEE1ALK

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 5 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-8138199-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-20 US disclosed
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 US disclosed
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases IMPACT BIOMEDICINES, INC. 2009-11-05 US disclosed
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-11-08 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 (3 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-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 EGFR 181/4885ULK1 514/4885SYK 281/4885
US-20090275582-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, JAK3 EGFR 181/4885ULK1 514/4885SYK 281/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 EGFR 181/4885ULK1 514/4885SYK 281/4885

“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.