SCHEMBL14543068

SCHEMBL14543068

Nc1cc(NC2CCC(N)CC2)nc2c(Br)cnn12

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 12/20 0.57
▸ MAPKAPK2 P49137 7/20 0.57
▸ GSK3B P49841 5/20 0.55
▸ CHEK1 O14757 2/20 0.49
▸ CCNA2 P20248 2/20 0.49
▸ CCNA1 P78396 2/20 0.49
▸ PIM1 P11309 3/20 0.42
▸ PIM2 Q9P1W9 2/20 0.42
▸ CSNK2B P67870 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
SCHEMBL11930829 1.00 CDK2 (0.57) CDK2MAPKAPK2GSK3BCHEK1CCNA2
SCHEMBL11930830 1.00 CDK2 (0.57) CDK2MAPKAPK2GSK3BCHEK1CCNA2
SCHEMBL11930815 0.85 CDK2 (0.47) CDK2MAPKAPK2GSK3BCHEK1CCNA2
SCHEMBL11930884 0.81 CDK2 (0.61) CDK2MAPKAPK2GSK3BCHEK1CCNA2
SCHEMBL14051006 0.78 PIM1 (0.43) CDK2MAPKAPK2GSK3BCHEK1CCNA2
SCHEMBL14051004 0.78 PIM1 (0.43) CDK2MAPKAPK2GSK3BCHEK1CCNA2
SCHEMBL11930841 0.76 CDK2 (0.44) CDK2MAPKAPK2GSK3BCHEK1CCNA2
SCHEMBL11930844 0.76 CDK2 (0.44) CDK2MAPKAPK2GSK3BCHEK1CCNA2
SCHEMBL11930825 0.75 CDK2 (0.47) CDK2MAPKAPK2GSK3BCHEK1CCNA2
SCHEMBL14427517 0.74 CDK2 (0.70) CDK2MAPKAPK2GSK3BCHEK1

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
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