SCHEMBL29684322

SCHEMBL29684322

CC(O)c1ccnc2c(F)cc(-c3nc(Nc4ccc(N5CCN(C(=O)OC(C)(C)C)CC5)cn4)ncc3F)cc12

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CDK6 Q00534 16/20 0.53
▸ CDK4 P11802 15/20 0.53
▸ CSF1R P07333 6/20 0.53
▸ PIK3CD O00329 2/20 0.53
▸ DYRK2 Q92630 4/20 0.49
▸ CCND1 P24385 2/20 0.47
▸ CCND3 P30281 3/20 0.47
▸ CDK2 P24941 3/20 0.47
▸ CDK9 P50750 3/20 0.47
▸ CCNT1 O60563 1/20 0.47
▸ CCNE1 P24864 1/20 0.47
▸ CDK7 P50613 1/20 0.47
▸ CCNH P51946 1/20 0.47
▸ CCNA2 P20248 4/20 0.46
▸ CDK1 P06493 2/20 0.46
▸ CCNK O75909 2/20 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
SCHEMBL24482800 1.00 CDK6 (0.53) CDK6CDK4CSF1RPIK3CDDYRK2
SCHEMBL24483230 0.92 CDK6 (0.49) CDK6CDK4CSF1RPIK3CDDYRK2
SCHEMBL29684434 0.92 CDK6 (0.49) CDK6CDK4CSF1RPIK3CDDYRK2
SCHEMBL29684228 0.90 CDK6 (0.56) CDK6CDK4CSF1RPIK3CDCCND1
SCHEMBL29684038 0.89 CDK6 (0.51) CDK6CDK4CSF1RPIK3CDDYRK2
SCHEMBL24482798 0.89 CDK6 (0.51) CDK6CDK4CSF1RPIK3CDDYRK2
SCHEMBL24483442 0.88 CDK6 (0.52) CDK6CDK4CSF1RPIK3CDDYRK2
SCHEMBL29684493 0.88 CDK6 (0.52) CDK6CDK4CSF1RPIK3CDDYRK2
SCHEMBL29684601 0.88 CDK6 (0.51) CDK6CDK4CSF1RPIK3CDCCND1
SCHEMBL24483429 0.88 CDK6 (0.53) CDK6CDK4CSF1RDYRK2CCND1

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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