SCHEMBL301856

SCHEMBL301856

CCNc1ncc(C)c(Nc2cccc(NC(C)=O)c2)n1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.64
JAK3 P52333 2/20 0.64
BTK Q06187 5/20 0.58
ITK Q08881 4/20 0.57
SYK P43405 1/20 0.54
MAP3K5 Q99683 1/20 0.53
STAT6 P42226 1/20 0.48
JAK2 O60674 1/20 0.48
HDAC1 Q13547 1/20 0.48
BRD4 O60885 2/20 0.48
ABL1 P00519 1/20 0.48
CSNK2A1 P68400 1/20 0.47
ABCG2 Q9UNQ0 1/20 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
SCHEMBL10259944 0.89 EGFR (0.68) EGFRJAK3BTKITKSYK
SCHEMBL12111063 0.88 EGFR (0.66) EGFRJAK3BTKITKSYK
SCHEMBL17915928 0.87 BTK (0.65) EGFRJAK3BTKITKSYK
SCHEMBL20216213 0.86 EGFR (0.77) EGFRJAK3BTKITKSYK
SCHEMBL21108821 0.85 EGFR (0.78) EGFRJAK3BTKITKSYK
SCHEMBL12111172 0.84 EGFR (0.60) EGFRJAK3BTKITKSYK
SCHEMBL270239 0.84 EGFR (0.58) EGFRJAK3BTKITKSYK
SCHEMBL12320591 0.83 EGFR (0.56) EGFRJAK3BTKITKSYK
SCHEMBL305045 0.83 SYK (0.78) EGFRJAK3BTKITKSYK
SCHEMBL301348 0.83 EGFR (0.55) EGFRJAK3BTKITKSYK

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 6 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-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-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 (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-20090286789-A1 Bi-Aryl Meta-Pyrimidine Inhibitors of Kinases JAK2, TYK2, LTK EGFR 335/4885JAK3 4/4885BTK 7/4885
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 EGFR 181/4885JAK3 3/4885BTK 9/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 EGFR 181/4885JAK3 3/4885BTK 9/4885

“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.