SCHEMBL30260886

SCHEMBL30260886

FC(F)(F)c1cnc(N[C@H]2CCCCNC2)nc1-c1c[nH]c2c(Cl)c(Cl)ccc12

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 20/20 0.77
▸ CCNK O75909 20/20 0.77
▸ CDK9 P50750 20/20 0.77
▸ CDK12 Q9NYV4 20/20 0.77
▸ CCNE1 P24864 17/20 0.77
▸ CDK2 P24941 17/20 0.77
▸ CDK7 P50613 7/20 0.69
▸ CCNH P51946 7/20 0.69
▸ MNAT1 P51948 4/20 0.69

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
SCHEMBL30260930 0.87 CCNT1 (0.70) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL24840743 0.87 CCNT1 (1.00) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL30260953 0.85 CCNT1 (0.75) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL30260911 0.84 CCNT1 (0.68) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL30261019 0.83 CCNT1 (0.68) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL29283734 0.83 CCNK (0.77) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL29283732 0.83 CCNK (0.77) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25591990 0.83 CCNT1 (0.67) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25580551 0.83 CCNT1 (0.69) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25597041 0.83 CCNT1 (0.67) CCNT1CCNKCDK9CDK12CCNE1

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-2023040998-A1 A CYCLIN-DEPENDENT KINASE INHIBITOR Taizhou Eoc Pharma Co., Ltd. (CN) 2023-03-23 — — WO disclosed
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