SCHEMBL31473405

SCHEMBL31473405

CN(c1ccc(C#N)cn1)C1CC2C(C1)C2(F)F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 10/20 0.44
JAK3 P52333 9/20 0.44
CCNA2 P20248 1/20 0.42
CDK2 P24941 1/20 0.42
EGLN2 Q96KS0 1/20 0.37
USP30 Q70CQ3 1/20 0.36
KCNH2 Q12809 1/20 0.35
JAK1 P23458 4/20 0.33
IRAK4 Q9NWZ3 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP2D6 P10635 1/20 0.33
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33

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
SCHEMBL27298649 1.00 JAK2 (0.44) JAK2JAK3CCNA2CDK2EGLN2
SCHEMBL27303359 0.83 JAK2 (0.46) JAK2JAK3CCNA2CDK2EGLN2
SCHEMBL27296079 0.81 CCNA2 (0.47) JAK2JAK3CCNA2CDK2EGLN2
SCHEMBL31473402 0.81 CCNA2 (0.47) JAK2JAK3CCNA2CDK2EGLN2
SCHEMBL27306410 0.81 JAK2 (0.47) JAK2JAK3CCNA2CDK2EGLN2
SCHEMBL31473466 0.81 JAK2 (0.47) JAK2JAK3CCNA2CDK2EGLN2
SCHEMBL27309439 0.80 JAK2 (0.43) JAK2JAK3CCNA2CDK2EGLN2
SCHEMBL31473394 0.79 JAK2 (0.45) JAK2JAK3CCNA2CDK2EGLN2
SCHEMBL27304976 0.79 JAK2 (0.47) JAK2JAK3CCNA2CDK2EGLN2
SCHEMBL31473344 0.78 JAK2 (0.49) JAK2JAK3CCNA2CDK2EGLN2

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-119866333-A KIT inhibitors, compounds, pharmaceutical compositions, and methods of use thereof 亚力维克希斯股份有限公司 2025-04-22 CN disclosed