SCHEMBL31666705

SCHEMBL31666705

FC(F)(F)c1cnc(N[C@H]2CCCNC2)nc1-c1c[nH]cn1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 20/20 0.61
▸ CDK12 Q9NYV4 20/20 0.61
▸ CCNT1 O60563 18/20 0.61
▸ CDK9 P50750 18/20 0.61
▸ CCNE1 P24864 16/20 0.61
▸ CDK2 P24941 16/20 0.61
▸ CDK7 P50613 6/20 0.61
▸ CCNH P51946 6/20 0.61
▸ MNAT1 P51948 5/20 0.61

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
SCHEMBL31666811 1.00 CCNK (0.61) CCNKCDK12CCNT1CDK9CCNE1
SCHEMBL22977485 0.87 ULK1 (0.47) CCNKCDK12CCNT1CDK9CCNE1
SCHEMBL31666740 0.84 CCNK (0.60) CCNKCDK12CCNT1CDK9CCNE1
SCHEMBL30927739 0.84 CCNK (0.60) CCNKCDK12CCNT1CDK9CCNE1
SCHEMBL25434961 0.82 CCNK (0.63) CCNKCDK12CCNT1CDK9CCNE1
SCHEMBL30927695 0.82 CCNK (0.63) CCNKCDK12CCNT1CDK9CCNE1
SCHEMBL22977457 0.82 CCNK (0.48) CCNKCDK12CCNT1CDK9CCNE1
SCHEMBL29749324 0.82 CCNK (0.63) CCNKCDK12CCNT1CDK9CCNE1
SCHEMBL22997812 0.82 CCNK (0.48) CCNKCDK12CCNT1CDK9CCNE1
SCHEMBL31666666 0.82 CCNK (0.65) CCNKCDK12CCNT1CDK9CCNE1

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
EP-4592283-A1 CYCLIN-DEPENDENT KINASE 7 INHIBITORS Joint Stock Company "Biocad" (RU) 2025-07-30 — — EP claimed
EP-4592283-A1 CYCLIN-DEPENDENT KINASE 7 INHIBITORS Joint Stock Company "Biocad" (RU) 2025-07-30 — — EP disclosed
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