SCHEMBL29355477

SCHEMBL29355477

N#Cc1cnn2c(NC3CC3)ccnc12

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.62
ALDH1A1 P00352 2/20 0.62
CSNK2A2 P19784 12/20 0.57
CSNK2A1 P68400 4/20 0.57
HPGD P15428 1/20 0.51
CLK4 Q9HAZ1 1/20 0.51
BCL6 P41182 1/20 0.49
CDK2 P24941 1/20 0.49
KDM4D Q6B0I6 1/20 0.49
CSNK2B P67870 1/20 0.48

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
Hydrochloric Acid SCHEMBL30279843 0.99 KDM4E (0.60) KDM4EALDH1A1CSNK2A2CSNK2A1HPGD
Trifluoroacetic Acid SCHEMBL30279847 0.88 BCL6 (0.51) KDM4EALDH1A1CSNK2A2CSNK2A1HPGD
SCHEMBL15288758 0.78 CDK2 (0.64) CSNK2A2CSNK2A1BCL6CDK2CSNK2B
SCHEMBL1935284 0.74 CSNK2B (0.61) KDM4EALDH1A1CSNK2A2CSNK2A1BCL6
SCHEMBL30279846 0.74 KDM4E (0.54) KDM4EALDH1A1CSNK2A2CSNK2A1HPGD
SCHEMBL29352517 0.74 CSNK2A2 (0.38) KDM4EALDH1A1CSNK2A2CSNK2A1
SCHEMBL172459 0.73 KDM4E (0.60) KDM4EALDH1A1CSNK2A1HPGDCLK4
SCHEMBL30279842 0.73 CSNK2A1 (0.58) KDM4EALDH1A1CSNK2A2CSNK2A1HPGD
SCHEMBL17502116 0.73 CSNK2A1 (1.00) CSNK2A2CSNK2A1BCL6CDK2CSNK2B
SCHEMBL26621936 0.72 KDM4E (0.59) KDM4EALDH1A1CSNK2A1HPGDCLK4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109562111-B CK2 inhibitors, compositions and methods thereof 北极星药业股份有限公司 2023-04-04 CN claimed
EP-3474855-B1 CK2 INHIBITORS, COMPOSITIONS AND METHODS THEREOF POLARIS PHARMACEUTICALS INC (US) 2022-01-26 EP claimed
CN-109562111-B CK2 inhibitors, compositions and methods thereof 北极星药业股份有限公司 2023-04-04 CN disclosed
EP-3474855-B1 CK2 INHIBITORS, COMPOSITIONS AND METHODS THEREOF POLARIS PHARMACEUTICALS INC (US) 2022-01-26 EP disclosed