SCHEMBL27720262

SCHEMBL27720262

Cc1nc(CN)sc1-c1ccnc(Nc2cccc(Cl)c2)n1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 13/20 0.76
CDK4 P11802 9/20 0.76
CAMK2D Q13557 2/20 0.55
CSNK2A1 P68400 1/20 0.53
ABL1 P00519 2/20 0.53
CCNT1 O60563 2/20 0.53
CDK1 P06493 2/20 0.53
CCNB1 P14635 2/20 0.53
CCNA2 P20248 2/20 0.53
CDK7 P50613 2/20 0.53
CDK9 P50750 2/20 0.53
CCNH P51946 2/20 0.53
AURKA O14965 1/20 0.53
CCNB2 O95067 1/20 0.53
CCNE2 O96020 1/20 0.53
CCND1 P24385 1/20 0.53
CCNE1 P24864 1/20 0.53
ABL2 P42684 1/20 0.53
GSK3B P49841 1/20 0.53
MNAT1 P51948 1/20 0.53

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
SCHEMBL4800928 0.87 CDK2 (0.79) CDK2CDK4CAMK2DCSNK2A1ABL1
SCHEMBL6159474 0.86 CDK2 (1.00) CDK2CDK4CDK1CDK7CDK9
SCHEMBL27720287 0.86 CDK2 (0.74) CDK2CDK4CAMK2DCSNK2A1ABL1
SCHEMBL27741459 0.86 CDK2 (0.73) CDK2CDK4CDK1CCNA2CDK7
SCHEMBL27741375 0.85 CDK2 (0.62) CDK2CDK4CAMK2DCSNK2A1ABL1
SCHEMBL6157845 0.83 CDK2 (0.78) CDK2CDK4ABL1CCNT1CDK1
SCHEMBL4799527 0.83 CDK2 (0.73) CDK2CDK4CAMK2DABL1CCNT1
SCHEMBL27741372 0.83 CDK2 (0.76) CDK2CDK4CAMK2DABL1CCNT1
SCHEMBL4802694 0.83 CDK2 (0.76) CDK2CDK4CAMK2DABL1CCNT1
SCHEMBL2286799 0.82 CDK2 (0.74) CDK2CDK4CAMK2DABL1CCNT1

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
CN-101309586-A Thiazole compounds as fungicides BAYER CROPSCIENCE AG (DE) 2008-11-19 CN disclosed