SCHEMBL13305391

SCHEMBL13305391

Bc1cnn2c(NCc3cccc(CN)c3)cc(-c3ccccc3Cl)nc12

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 9/20 0.58
▸ GSK3B P49841 10/20 0.58
▸ CCNA2 P20248 1/20 0.42
▸ CCNA1 P78396 1/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CCNE1 P24864 1/20 0.39
▸ KCNN3 Q9UGI6 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
SCHEMBL13289612 0.90 CDK2 (0.60) CDK2GSK3BCCNA2CCNA1MEN1
SCHEMBL12953716 0.88 CDK2 (0.75) CDK2GSK3BCCNA2CCNA1CCNE1
SCHEMBL13288765 0.87 CDK2 (0.55) CDK2GSK3BCCNA2CCNA1MEN1
SCHEMBL13305688 0.86 GSK3B (0.56) CDK2GSK3BCCNA2CCNA1MEN1
SCHEMBL13289375 0.86 CDK2 (0.54) CDK2GSK3BCCNA2CCNA1MEN1
SCHEMBL13305196 0.86 CDK2 (0.63) CDK2GSK3BCCNA2CCNA1MEN1
SCHEMBL13305378 0.85 CDK2 (0.59) CDK2GSK3BCCNA2CCNA1MEN1
SCHEMBL13305338 0.85 CDK2 (0.79) CDK2GSK3BCCNE1
SCHEMBL13288974 0.85 CDK2 (0.52) CDK2GSK3BCCNA2CCNA1MEN1
SCHEMBL12954278 0.85 CDK2 (0.52) CDK2GSK3BCCNA2CCNA1MEN1

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
EP-1537116-B1 PYRAZOLOPYRIMIDINES SUITABLE FOR THE TREATMENT OF CANCER DISEASES SCHERING CORP (US) 2010-06-02 — — EP disclosed
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