SCHEMBL24257799

SCHEMBL24257799

Cc1c(-c2cnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2)cnc(C#N)c1OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 1/20 0.47
RET P07949 2/20 0.45
MET P08581 3/20 0.43
CCNC P24863 1/20 0.41
CDK8 P49336 1/20 0.41
MAP3K7 O43318 3/20 0.41
TAB1 Q15750 3/20 0.41
TTK P33981 2/20 0.41
FGFR1 P11362 1/20 0.41
FGFR2 P21802 1/20 0.41
FGFR4 P22455 1/20 0.41
FGFR3 P22607 1/20 0.41
KDR P35968 1/20 0.41
FLT3 P36888 1/20 0.41
PRMT5 O14744 2/20 0.40
GPR119 Q8TDV5 2/20 0.40
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
YAP1 P46937 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
SCHEMBL30453163 1.00 TNK2 (0.47) TNK2RETMETCCNCCDK8
SCHEMBL24257696 0.89 TNK2 (0.48) TNK2RETMETCCNCCDK8
SCHEMBL24257732 0.83 CCNC (0.49) TNK2RETMETCCNCCDK8
SCHEMBL30452665 0.83 CCNC (0.49) TNK2RETMETCCNCCDK8
SCHEMBL24257712 0.82 MEN1 (0.48) TNK2METTTKGPR119
SCHEMBL30452371 0.82 MEN1 (0.48) TNK2METTTKGPR119
SCHEMBL24257541 0.82 IRAK4 (0.44) RETMET
SCHEMBL27040146 0.79 TNK2 (0.49) TNK2RETMETCCNCCDK8
SCHEMBL1653749 0.76 TNK2 (0.56) TNK2METCCNCCDK8FGFR1
SCHEMBL24257678 0.73 GRM4 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116670131-A PHD inhibitor compounds, compositions, and methods of use 阿克比治疗有限公司 2023-08-29 CN disclosed
WO-2022036188-A1 PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND METHODS OF USE AKEBIA THERAPEUTICS, INC. (US) 2022-02-17 WO disclosed