SCHEMBL24482655

SCHEMBL24482655

CC(C)(C)OC(=O)N1CCN(c2ccc(Nc3ncc(F)c(-c4cc(F)c5ncccc5c4)n3)nc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ DYRK2 Q92630 4/20 0.53
▸ CDK4 P11802 14/20 0.51
▸ CDK6 Q00534 14/20 0.51
▸ CSF1R P07333 2/20 0.51
▸ PIK3CD O00329 1/20 0.51
▸ CCND3 P30281 11/20 0.50
▸ CDK2 P24941 5/20 0.50
▸ CCNT1 O60563 1/20 0.50
▸ CCNE1 P24864 1/20 0.50
▸ CDK7 P50613 1/20 0.50
▸ CDK9 P50750 1/20 0.50
▸ CCNH P51946 1/20 0.50
▸ CDK1 P06493 6/20 0.49
▸ CCNA2 P20248 6/20 0.49
▸ CCNE2 O96020 3/20 0.48
▸ CCND1 P24385 2/20 0.48
▸ ALK Q9UM73 1/20 0.48
▸ PIM1 P11309 1/20 0.48
▸ CDK5 Q00535 1/20 0.47

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
SCHEMBL29684007 1.00 DYRK2 (0.53) DYRK2CDK4CDK6CSF1RPIK3CD
SCHEMBL29684290 0.89 DYRK2 (0.60) DYRK2CDK4CDK6CSF1RPIK3CD
SCHEMBL29684267 0.89 DYRK2 (0.53) DYRK2CDK4CDK6CSF1RPIK3CD
SCHEMBL24483228 0.89 DYRK2 (0.60) DYRK2CDK4CDK6CSF1RPIK3CD
SCHEMBL29684202 0.89 CDK6 (0.63) CDK4CDK6CSF1RPIK3CDCCND3
SCHEMBL24483253 0.89 CDK6 (0.63) CDK4CDK6CSF1RPIK3CDCCND3
Hydrochloric Acid SCHEMBL29684426 0.88 CDK6 (0.62) CDK4CDK6CSF1RPIK3CDCCND3
SCHEMBL29684466 0.88 CDK6 (0.54) DYRK2CDK4CDK6CSF1RPIK3CD
SCHEMBL24482798 0.87 CDK6 (0.51) DYRK2CDK4CDK6CSF1RPIK3CD
SCHEMBL29684038 0.87 CDK6 (0.51) DYRK2CDK4CDK6CSF1RPIK3CD

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