SCHEMBL24482798

SCHEMBL24482798

CC(C)(C)OC(=O)N1CCN(c2ccc(Nc3ncc(F)c(-c4cc(F)c5nccc(C(C)(C)O)c5c4)n3)nc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CDK6 Q00534 12/20 0.51
▸ CCND1 P24385 3/20 0.51
▸ CDK4 P11802 12/20 0.51
▸ DYRK2 Q92630 4/20 0.51
▸ CSF1R P07333 2/20 0.51
▸ PIK3CD O00329 1/20 0.51
▸ CCND3 P30281 7/20 0.49
▸ CDK2 P24941 3/20 0.49
▸ CCNT1 O60563 1/20 0.49
▸ CCNE1 P24864 1/20 0.49
▸ CDK7 P50613 1/20 0.49
▸ CDK9 P50750 1/20 0.49
▸ CCNH P51946 1/20 0.49
▸ CDK1 P06493 3/20 0.47
▸ CCNA2 P20248 3/20 0.47
▸ WNT3A P56704 1/20 0.47
▸ CCNE2 O96020 2/20 0.46
▸ ALK Q9UM73 1/20 0.46
▸ PIM1 P11309 1/20 0.46

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
SCHEMBL29684038 1.00 CDK6 (0.51) CDK6CCND1CDK4DYRK2CSF1R
SCHEMBL24483445 0.92 DYRK2 (0.51) CDK6CCND1CDK4DYRK2CSF1R
SCHEMBL29683868 0.92 DYRK2 (0.51) CDK6CCND1CDK4DYRK2CSF1R
SCHEMBL29684322 0.89 CDK6 (0.53) CDK6CCND1CDK4DYRK2CSF1R
SCHEMBL24482800 0.89 CDK6 (0.53) CDK6CCND1CDK4DYRK2CSF1R
SCHEMBL24482976 0.88 DYRK2 (0.51) CDK6CCND1CDK4DYRK2CSF1R
SCHEMBL29684632 0.88 DYRK2 (0.51) CDK6CCND1CDK4DYRK2CSF1R
SCHEMBL24483416 0.87 CDK6 (0.51) CDK6CCND1CDK4DYRK2CSF1R
SCHEMBL29684097 0.87 CDK6 (0.51) CDK6CCND1CDK4DYRK2CSF1R
SCHEMBL24482655 0.87 DYRK2 (0.53) CDK6CCND1CDK4DYRK2CSF1R

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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