SCHEMBL30260995

SCHEMBL30260995

N#Cc1cccc2c(-c3nc(N[C@H]4CCCCNC4)ncc3C(F)(F)F)c[nH]c12

nearest known ligand 0.95

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 19/20 0.95
▸ CCNK O75909 19/20 0.95
▸ CDK9 P50750 19/20 0.95
▸ CDK12 Q9NYV4 19/20 0.95
▸ CCNE1 P24864 17/20 0.95
▸ CDK2 P24941 17/20 0.95
▸ CDK7 P50613 8/20 0.73
▸ CCNH P51946 8/20 0.73
▸ MNAT1 P51948 5/20 0.73

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
SCHEMBL24839829 0.97 CCNK (1.00) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL30204442 0.87 CCNK (1.00) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL24839376 0.87 CCNK (1.00) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL28817251 0.85 CCNK (0.77) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL30006623 0.85 CCNK (0.77) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL28817252 0.85 CCNK (0.77) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL30260922 0.85 CCNT1 (0.76) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL30260790 0.85 CCNT1 (0.75) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL24840743 0.85 CCNT1 (1.00) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL24839802 0.85 CCNT1 (1.00) 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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