SCHEMBL3278545

SCHEMBL3278545

N#Cc1ncnc(Nc2cccc(-c3ccc(CN)cc3)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SYK P43405 13/20 0.47
CDC7 O00311 1/20 0.44
MAPK8 P45983 2/20 0.42
PIK3CG P48736 2/20 0.42
GSK3B P49841 2/20 0.42
CAMKK2 Q96RR4 2/20 0.42
CSF1R P07333 1/20 0.41
PDGFRB P09619 1/20 0.41
GSK3A P49840 1/20 0.41
CDK9 P50750 1/20 0.41
CDK5 Q00535 1/20 0.41
ACVR1 Q04771 1/20 0.41
CDK5R1 Q15078 1/20 0.41
TAOK1 Q7L7X3 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
PTK2 Q05397 1/20 0.40

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
SCHEMBL3284339 0.78 SYK (0.51) SYKMAPK8PIK3CGGSK3BCAMKK2
SCHEMBL27692143 0.76 SYK (0.57) SYKMAPK8PIK3CGGSK3BCAMKK2
SCHEMBL28347893 0.74 BCL6 (0.57) CDC7
SCHEMBL20184437 0.70 JAK3 (0.47)
SCHEMBL6239975 0.68 TDP1 (0.56)
SCHEMBL3277202 0.67 LOXL2 (0.43)
SCHEMBL15245751 0.65 LOXL2 (0.59) GSK3BGSK3A
SCHEMBL17006538 0.64 SYK (1.00) SYK
SCHEMBL27692141 0.64 TAAR1 (0.53) SYKMAPK8GSK3BCSF1RGSK3A
SCHEMBL19347449 0.64 SYK (1.00) SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214548-A1 2-Cyano-Pyrimidines and-Triazines as Cysteine Protease Inhibitors FLOHR STEFANIE 2008-09-04 US claimed
EP-1907368-A1 2-CYANO-PYRIMIDINES AND -TRIAZINES AS CYSTEINE PROTEASE INHIBITORS Novartis AG (CH) 2008-04-09 EP claimed
WO-2007009715-A1 2-CYANO-PYRIMIDINES AND -TRIAZINES AS CYSTEINE PROTEASE INHIBITORS NOVARTIS AG (CH) 2007-01-25 WO claimed
US-7700605-B2 2-cyano-pyrimidines and-triazines as cysteine protease inhibitors NOVARTIS AG (CH) 2010-04-20 US disclosed
US-20080214548-A1 2-Cyano-Pyrimidines and-Triazines as Cysteine Protease Inhibitors FLOHR STEFANIE 2008-09-04 US disclosed
EP-1907368-A1 2-CYANO-PYRIMIDINES AND -TRIAZINES AS CYSTEINE PROTEASE INHIBITORS Novartis AG (CH) 2008-04-09 EP disclosed
WO-2007009715-A1 2-CYANO-PYRIMIDINES AND -TRIAZINES AS CYSTEINE PROTEASE INHIBITORS NOVARTIS AG (CH) 2007-01-25 WO 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 (1 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-20080214548-A1 2-Cyano-Pyrimidines and-Triazines as Cysteine Protease Inhibitors USP2, UCHL3, UCHL5 SYK 2505/4885CDC7 2196/4885MAPK8 4595/4885

“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.