SCHEMBL30771916

SCHEMBL30771916

Cc1noc(C)c1-c1ccc2c(-c3nc(N[C@H]4CCC[C@@H]4N4CCC4)ncc3C(F)(F)F)c[nH]c2n1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 16/20 0.69
▸ CDK12 Q9NYV4 16/20 0.69
▸ CCNT1 O60563 13/20 0.69
▸ CCNE1 P24864 13/20 0.69
▸ CDK2 P24941 13/20 0.69
▸ CDK9 P50750 13/20 0.69
▸ CDK7 P50613 12/20 0.69
▸ CCNH P51946 12/20 0.69
▸ MNAT1 P51948 8/20 0.43

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
SCHEMBL30771912 1.00 CCNK (0.69) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL21184364 1.00 CCNK (0.69) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL30771949 0.98 CCNK (0.69) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL21184360 0.98 CCNK (0.69) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL24176334 0.95 CCNK (0.69) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL21184365 0.95 CCNK (0.69) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL21178979 0.95 CCNK (0.69) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL30771934 0.95 CCNK (0.69) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL21184367 0.93 CCNK (0.66) CCNKCDK12CCNT1CCNE1CDK2
SCHEMBL21184366 0.93 CCNK (0.66) CCNKCDK12CCNT1CCNE1CDK2

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
EP-3740206-B1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS INC (US) 2024-03-06 — — EP disclosed
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