SCHEMBL29684290

SCHEMBL29684290

CC(C)(C)OC(=O)N1CCN(c2ccc(Nc3ncc(F)c(-c4ccc5ncccc5c4)n3)nc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DYRK2 Q92630 8/20 0.60
▸ CDK6 Q00534 11/20 0.55
▸ PIM1 P11309 5/20 0.55
▸ CCND1 P24385 2/20 0.50
▸ PIK3CD O00329 1/20 0.48
▸ CSF1R P07333 1/20 0.48
▸ CDK4 P11802 1/20 0.48
▸ ALK Q9UM73 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
SCHEMBL24483228 1.00 DYRK2 (0.60) DYRK2CDK6PIM1CCND1PIK3CD
SCHEMBL24482655 0.89 DYRK2 (0.53) DYRK2CDK6PIM1CCND1PIK3CD
SCHEMBL29684498 0.89 DYRK2 (0.51) DYRK2CDK6PIM1CCND1PIK3CD
SCHEMBL24483258 0.89 DYRK2 (0.51) DYRK2CDK6PIM1CCND1PIK3CD
SCHEMBL29684007 0.89 DYRK2 (0.53) DYRK2CDK6PIM1CCND1PIK3CD
SCHEMBL26447886 0.86 DYRK2 (0.81) DYRK2CDK6PIM1
SCHEMBL30569706 0.86 DYRK2 (0.81) DYRK2CDK6PIM1
SCHEMBL24482654 0.85 CDK6 (0.68) CDK6PIM1CCND1CDK4
SCHEMBL29683938 0.85 CDK6 (0.68) CDK6PIM1CCND1CDK4
SCHEMBL28619505 0.84 CDK6 (0.72) DYRK2CDK6PIM1CCND1PIK3CD

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
WO-2022113003-A1 CDK INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2022-06-02 — — WO claimed
WO-2022113003-A1 CDK INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2022-06-02 — — WO disclosed
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