SCHEMBL13309319

SCHEMBL13309319

COCCNS(=O)(=O)c1ccc(Nc2cc(-c3ccccc3F)nc3c(Br)cnn23)cc1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 7/20 0.64
▸ CDK2 P24941 13/20 0.50
▸ CCNA2 P20248 1/20 0.49
▸ CCNA1 P78396 1/20 0.49
▸ CDK1 P06493 1/20 0.42
▸ CDK4 P11802 3/20 0.41
▸ SYK P43405 1/20 0.39

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
SCHEMBL13309467 0.89 GSK3B (0.67) GSK3BCDK2CCNA2CCNA1SYK
SCHEMBL11931063 0.88 GSK3B (0.54) GSK3BCDK2CCNA2CCNA1CDK1
SCHEMBL13885032 0.84 GSK3B (0.79) GSK3BCDK2CCNA2CCNA1
SCHEMBL13308740 0.82 GSK3B (0.76) GSK3BCDK2CCNA2CCNA1
SCHEMBL13309248 0.78 GSK3B (0.54) GSK3BCDK2CCNA2CCNA1
SCHEMBL13308741 0.78 GSK3B (0.57) GSK3BCDK2CCNA2CCNA1
SCHEMBL13893732 0.77 GSK3B (0.83) GSK3BCDK2CCNA2CCNA1
SCHEMBL13998502 0.77 GSK3B (0.87) GSK3BCDK2CCNA2CCNA1
SCHEMBL13308746 0.77 GSK3B (0.51) GSK3BCDK2CCNA2CCNA1CDK1
SCHEMBL11931064 0.77 GSK3B (0.55) GSK3BCDK2CCNA2CCNA1CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759531-B2 Preparation method of fluoro-substituted deuterated diphenylurea Suzhou Zelgen Biopharmaccceutical Co., Ltd. (CN) 2014-06-24 — — US disclosed
EP-1934224-B1 PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS FOR THE TREATMENT OF CANCER SCHERING CORP (US) 2010-06-09 — — EP disclosed
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