SCHEMBL14633488

SCHEMBL14633488

CS(=O)(=O)c1cc(Nc2ncc(-c3n[nH]c4ccc(F)cc34)c(N)n2)ccc1F

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 2/20 0.49
NTRK1 P04629 6/20 0.45
SGK1 O00141 5/20 0.42
NTRK2 Q16620 1/20 0.42
CHEK1 O14757 1/20 0.39
PRKD3 O94806 1/20 0.39
CDK8 P49336 1/20 0.39
LIMK1 P53667 1/20 0.39
ROCK1 Q13464 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
RIPK2 O43353 1/20 0.39
MAP2K4 P45985 2/20 0.38
ITK Q08881 1/20 0.38
MAP2K7 O14733 1/20 0.37

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
SCHEMBL2468759 0.92 NTRK1 (0.44) GRM4NTRK1NTRK2CHEK1PRKD3
SCHEMBL2471278 0.91 RIPK2 (0.43) GRM4NTRK1SGK1CHEK1PRKD3
SCHEMBL14634192 0.90 NTRK1 (0.42) GRM4NTRK1SGK1NTRK2RIPK2
SCHEMBL14634112 0.89 GRM4 (0.52) GRM4NTRK1SGK1NTRK2RIPK2
SCHEMBL14633733 0.88 PTGS2 (0.49) NTRK1NTRK2CHEK1PRKD3CDK8
SCHEMBL14634034 0.86 EPHB4 (0.49) NTRK2ROCK1CLK4DYRK1BRIPK2
SCHEMBL14634292 0.85 RIPK2 (0.44) NTRK1NTRK2RIPK2MAP2K4ITK
SCHEMBL14634186 0.84 RIPK2 (0.41) NTRK1SGK1NTRK2CHEK1PRKD3
SCHEMBL2466308 0.84 GRM4 (0.41) GRM4NTRK1SGK1NTRK2CHEK1
SCHEMBL2471505 0.84 RIPK2 (0.42) NTRK1NTRK2RIPK2MAP2K4ITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130023534-A1 PYRAZOLYL-PYRIMIDINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-24 US claimed
US-20130023532-A1 INDAZOLYL-PYRIMIDINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-24 US claimed
US-20130023532-A1 INDAZOLYL-PYRIMIDINES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-24 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 (2 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-20130023532-A1 INDAZOLYL-PYRIMIDINES AS KINASE INHIBITORS MAP3K19, MAP3K1, MAP3K20 GRM4 4019/4885NTRK1 797/4885SGK1 546/4885
US-20130023534-A1 PYRAZOLYL-PYRIMIDINES AS KINASE INHIBITORS CDK2, MAP3K19, MAP3K1 GRM4 3206/4885NTRK1 628/4885SGK1 841/4885

“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.