SCHEMBL14543183

SCHEMBL14543183

CS(=O)(=O)Nc1cc(-c2ccccc2F)nc2c(Br)cnn12

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 9/20 0.67
▸ CDK2 P24941 10/20 0.61
▸ CCNA2 P20248 2/20 0.60
▸ CCNA1 P78396 2/20 0.60
▸ CHEK1 O14757 1/20 0.39
▸ CCNE1 P24864 1/20 0.39
▸ ALOX5AP P20292 2/20 0.39
▸ FEN1 P39748 2/20 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
SCHEMBL13885032 0.86 GSK3B (0.79) GSK3BCDK2CCNA2CCNA1
SCHEMBL13305408 0.85 GSK3B (0.74) GSK3BCDK2CCNA2CCNA1CHEK1
SCHEMBL11931128 0.84 CDK2 (0.64) GSK3BCDK2CCNA2CCNA1CCNE1
SCHEMBL13116761 0.83 GSK3B (0.77) GSK3BCDK2CCNA2CCNA1CCNE1
SCHEMBL13308740 0.81 GSK3B (0.76) GSK3BCDK2CCNA2CCNA1CCNE1
SCHEMBL13146282 0.80 GSK3B (0.73) GSK3BCDK2CCNA2CCNA1CCNE1
SCHEMBL12954166 0.80 GSK3B (0.78) GSK3BCDK2CCNA2CCNA1CCNE1
SCHEMBL13118443 0.80 GSK3B (0.78) GSK3BCDK2CCNA2CCNA1CCNE1
SCHEMBL13116963 0.80 GSK3B (0.74) GSK3BCDK2CCNA2CCNA1CCNE1
SCHEMBL12953281 0.79 GSK3B (0.72) GSK3BCDK2CCNA2CCNA1CCNE1

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
WO-2007044441-A2 USE OF PYRAZOLO [1 , 5 -A] PYRIMIDINE DERIVATIVES FOR INHIBITING PROTEIN KINASES METHODS FOR INHIBITING PROTEIN KINASES SCHERING CORPORATION (US) 2007-04-19 — — WO disclosed
Send feedback