SCHEMBL25593099

SCHEMBL25593099

CCP(=O)(CC)c1c(C#N)ccc2c(-c3nc(N[C@H]4CCC(C)(C)NC4)ncc3C(F)(F)F)c[nH]c12

nearest known ligand 0.85

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 16/20 0.85
▸ CDK12 Q9NYV4 16/20 0.85
▸ CCNT1 O60563 14/20 0.85
▸ CCNE1 P24864 14/20 0.85
▸ CDK2 P24941 14/20 0.85
▸ CDK9 P50750 14/20 0.85
▸ CDK7 P50613 12/20 0.85
▸ CCNH P51946 12/20 0.85
▸ MNAT1 P51948 8/20 0.85
▸ CYP2D6 P10635 1/20 0.85

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
Sy-5609 SCHEMBL29855824 0.92 CDK7 (1.00) CCNKCDK12CCNT1CCNE1CDK2
Sy-5609 SCHEMBL22076285 0.92 CDK7 (1.00) CCNKCDK12CCNT1CCNE1CDK2
Sy-5609 SCHEMBL22076284 0.92 CDK7 (1.00) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL24308148 0.89 CCNK (0.86) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL30260734 0.87 CCNK (0.71) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL22076294 0.86 CCNK (0.79) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL22076296 0.86 CCNK (0.79) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL25593809 0.85 CDK7 (0.86) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL25597569 0.85 CCNK (0.77) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL25593057 0.84 CCNK (0.76) CCNKCDK12CCNT1CCNE1CDK2

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
EP-4186895-A1 COMPOUND USEFUL AS CDK7 KINASE INHIBITOR AND USE THEREOF TYK Medicines Inc. (CN) 2023-05-31 — — EP disclosed
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