SCHEMBL28592103

SCHEMBL28592103

[c]1ccc(-c2c(-c3ccccc3)ccnc2-c2ccccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 5/20 0.39
CDK2 P24941 5/20 0.39
LRRK2 Q5S007 2/20 0.37
CDK5 Q00535 2/20 0.37
CDK7 P50613 2/20 0.37
IKBKB O14920 1/20 0.37
CHUK O15111 1/20 0.37
DAPK3 O43293 1/20 0.37
JAK2 O60674 1/20 0.37
PRKD3 O94806 1/20 0.37
MAP4K4 O95819 1/20 0.37
PAK4 O96013 1/20 0.37
CSF1R P07333 1/20 0.37
RET P07949 1/20 0.37
IGF1R P08069 1/20 0.37
FGFR1 P11362 1/20 0.37
PRKACA P17612 1/20 0.37
FLT1 P17948 1/20 0.37
LTK P29376 1/20 0.37
GRK5 P34947 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
SCHEMBL996432 0.89 CCNA2 (0.45) CCNA2CDK2LRRK2CDK5CDK7
SCHEMBL8444233 0.87 CCNA2 (0.44) CCNA2CDK2LRRK2CDK5CDK7
SCHEMBL2321948 0.87 CCNA2 (0.44) CCNA2CDK2LRRK2CDK5CDK7
SCHEMBL321472 0.87 CCNA2 (0.44) CCNA2CDK2LRRK2CDK5CDK7
SCHEMBL4618932 0.87 CCNA2 (0.44) CCNA2CDK2LRRK2CDK5CDK7
SCHEMBL28592415 0.83 CCNA2 (0.37) CCNA2CDK2LRRK2CDK5CDK7
SCHEMBL30335027 0.82 ADORA2A (0.50) CCNA2CDK2PRKD3MAP4K4FGFR1
Boric Acid SCHEMBL28009850 0.82 CCNA2 (0.41) CCNA2CDK2LRRK2CDK5CDK7
Thiophene SCHEMBL28457018 0.79 CCNA2 (0.39) CCNA2CDK2LRRK2CDK5CDK7
SCHEMBL18050348 0.79 CYP3A4 (0.47) CCNA2CDK2CDK5MEN1ALDH1A1

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-109311844-B Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component 东曹株式会社 2021-07-20 CN disclosed