SCHEMBL6596348

SCHEMBL6596348

COCCn1c(-c2ccnc(N)n2)cnc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.46
CCNT1 O60563 3/20 0.46
CDK9 P50750 3/20 0.46
DYRK3 O43781 2/20 0.46
DYRK2 Q92630 2/20 0.46
DYRK1B Q9Y463 2/20 0.46
TDP1 Q9NUW8 2/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.45
ALOX15 P16050 1/20 0.44
CDK2 P24941 8/20 0.43
CDK4 P11802 3/20 0.43
CDK5 Q00535 3/20 0.40
CDK5R1 Q15078 3/20 0.40
MAP3K14 Q99558 1/20 0.40
CDC7 O00311 3/20 0.39
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
TTK P33981 1/20 0.37
CCNA2 P20248 1/20 0.37

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
SCHEMBL27534151 0.83 CDC7 (0.54) DYRK1ACCNT1CDK9DYRK3DYRK2
SCHEMBL6595714 0.82 CDK2 (0.52) DYRK1ACCNT1CDK9DYRK3DYRK2
SCHEMBL6596886 0.81 DYRK3 (0.40) DYRK1ACCNT1CDK9DYRK3DYRK2
SCHEMBL4024077 0.78 CDK2 (0.46) DYRK1ACCNT1CDK9DYRK3DYRK2
SCHEMBL6105497 0.77 CDK2 (0.51) DYRK1ACCNT1CDK9DYRK3DYRK2
SCHEMBL4030274 0.76 CDK2 (0.54) DYRK1ACCNT1CDK9DYRK3DYRK2
SCHEMBL1448411 0.74 CDK2 (0.50) DYRK1ACCNT1CDK9DYRK3DYRK2
SCHEMBL4024211 0.73 CCNT1 (0.48) DYRK1ACCNT1CDK9DYRK3DYRK2
SCHEMBL6706964 0.72 CDK2 (0.67) CCNT1CDK9CDK2CDK4CDK5
SCHEMBL26544453 0.72 ALDH1A1 (0.46) TDP1ALDH1A1LMNAALOX15

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-1351958-B1 IMIDAZOLO-5-YL-2-ANILINO-PYRIMIDINES AS AGENTS FOR THE INHIBITION OF THE CELL PROLIFERATION ASTRAZENECA AB (SE) 2004-06-16 EP disclosed