SCHEMBL31666586

SCHEMBL31666586

O=c1ncccc2c(-c3nc(NC4CCCNC4)ncc3C(F)(F)F)c[nH]c12

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 19/20 0.76
▸ CCNK O75909 19/20 0.76
▸ CDK9 P50750 19/20 0.76
▸ CDK12 Q9NYV4 19/20 0.76
▸ CCNE1 P24864 16/20 0.76
▸ CDK2 P24941 16/20 0.76
▸ CDK7 P50613 7/20 0.76
▸ CCNH P51946 7/20 0.76
▸ MNAT1 P51948 5/20 0.76

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
SCHEMBL31666762 1.00 CCNT1 (0.76) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL29283736 0.89 CCNT1 (0.78) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL29749340 0.89 CCNT1 (0.78) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL29283738 0.89 CCNT1 (0.78) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL31666680 0.87 CCNK (0.81) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL31666555 0.87 CCNK (0.81) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL24840734 0.86 CCNT1 (1.00) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL24839802 0.86 CCNT1 (1.00) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL24840743 0.86 CCNT1 (1.00) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL29498441 0.86 CCNT1 (0.81) 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 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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