SCHEMBL30260809

SCHEMBL30260809

FC(F)(F)c1cnc(Cl)nc1-c1c[nH]c2c(Cl)c(Cl)ccc12

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 17/20 0.45
CCNK O75909 17/20 0.45
CDK9 P50750 17/20 0.45
CDK12 Q9NYV4 17/20 0.45
CCNE1 P24864 15/20 0.45
CDK2 P24941 15/20 0.45
RPS6KA5 O75582 2/20 0.41
CDK7 P50613 5/20 0.39
CCNH P51946 5/20 0.39
MNAT1 P51948 2/20 0.39
AR P10275 1/20 0.36

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
SCHEMBL21179033 0.88 CCNT1 (0.43) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL30456841 0.85 CCNT1 (0.59) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL21179174 0.85 CCNK (0.49) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL30260990 0.84 AR (0.43) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL24588222 0.82 CCNT1 (0.41) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL29492523 0.82 CCNT1 (0.41) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL24900464 0.81 CCNT1 (0.48) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL30957488 0.81 CCNT1 (0.48) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25363465 0.81 CCNE1 (0.41) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL31122437 0.81 CCNE1 (0.41) 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