SCHEMBL14959269

SCHEMBL14959269

Cc1cc(Nc2cccc(NC(=O)OC(C)(C)C)c2)ncn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.53
SYK P43405 1/20 0.49
BRD4 O60885 1/20 0.48
EGFR P00533 7/20 0.47
TUBB4A P04350 1/20 0.47
TUBB P07437 1/20 0.47
TUBA3C P0DPH7 1/20 0.47
TUBA1B P68363 1/20 0.47
TUBA4A P68366 1/20 0.47
TUBB4B P68371 1/20 0.47
TUBB3 Q13509 1/20 0.47
TUBB2A Q13885 1/20 0.47
TUBB8 Q3ZCM7 1/20 0.47
TUBA3E Q6PEY2 1/20 0.47
TUBA1A Q71U36 1/20 0.47
TUBA1C Q9BQE3 1/20 0.47
TUBB6 Q9BUF5 1/20 0.47
TUBB2B Q9BVA1 1/20 0.47
TUBB1 Q9H4B7 1/20 0.47
CDK1 P06493 1/20 0.45

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
SCHEMBL690643 0.88 CDK1 (0.49) SYKBRD4EGFRTUBB4ATUBB
SCHEMBL691488 0.87 CDK1 (0.48) SYKBRD4EGFRTUBB4ATUBB
SCHEMBL12388686 0.85 EGFR (0.50) THRBSYKBRD4EGFRTUBB4A
SCHEMBL19890987 0.84 L3MBTL1 (0.44) THRBMAP4K4
SCHEMBL13148498 0.82 EGFR (0.45) SYKBRD4EGFRTUBB4ATUBB
SCHEMBL13148414 0.80 KDR (0.53) KDR
SCHEMBL691467 0.80 EGFR (0.47) SYKBRD4EGFRTUBB4ATUBB
SCHEMBL29029431 0.80 HDAC3 (0.56) SYKBRD4CYP17A1LMNAMAPT
SCHEMBL2205381 0.79 EGFR (0.52) SYKEGFRTUBB4ATUBBTUBA3C
SCHEMBL6869447 0.77 LMNA (0.51) SYKBRD4CYP17A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8445498-B2 4,6-disubstituted pyrimidines useful as kinase inhibitors CELGENE AVILOMICS RESEARCH, INC. (US) 2013-05-21 US disclosed