SCHEMBL24087428

SCHEMBL24087428

CC1(C)CC[C@H](Nc2ncc(C(F)(F)F)c(-c3cn(S(=O)(=O)c4ccccc4)c4cc(-c5nccs5)ccc34)n2)CN1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 17/20 0.52
▸ CDK12 Q9NYV4 17/20 0.52
▸ CDK7 P50613 13/20 0.52
▸ CCNH P51946 13/20 0.52
▸ CCNT1 O60563 12/20 0.52
▸ CDK9 P50750 12/20 0.52
▸ CCNE1 P24864 11/20 0.52
▸ CDK2 P24941 11/20 0.52
▸ MNAT1 P51948 11/20 0.48
▸ CYP2D6 P10635 1/20 0.45

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
SCHEMBL24087425 0.88 CCNK (0.56) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL27140505 0.87 CDK7 (0.63) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL25271440 0.87 CDK7 (0.63) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL24087376 0.86 CCNK (0.51) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL21188590 0.80 CCNK (0.75) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL21188326 0.80 CCNK (0.75) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL25596320 0.77 CCNK (0.66) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL24584481 0.75 CDK7 (0.49) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL24584483 0.75 CDK7 (0.49) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL30439572 0.74 CCNK (0.63) CCNKCDK12CDK7CCNHCCNT1

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
US-11311542-B2 Inhibitors of cyclin dependent kinase 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2022-04-26 — — US disclosed
US-20210379065-A1 INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2021-12-09 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11311542-B2 Inhibitors of cyclin dependent kinase 7 (CDK7) CDK7, CDK3, CCNK CCNK 3/4885CDK12 27/4885CDK7 1/4885
US-20210379065-A1 INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CCNK CCNK 3/4885CDK12 27/4885CDK7 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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