SCHEMBL24839617

SCHEMBL24839617

CCc1cnc(N)nc1-c1c[nH]c2cc(C#N)ccc12

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CLK1 P49759 8/20 0.49
▸ CDK5 Q00535 4/20 0.49
▸ CDK5R1 Q15078 4/20 0.49
▸ MAP3K14 Q99558 2/20 0.47
▸ CCNK O75909 8/20 0.44
▸ CDK12 Q9NYV4 8/20 0.44
▸ CCNT1 O60563 5/20 0.44
▸ CCNE1 P24864 5/20 0.44
▸ CDK2 P24941 5/20 0.44
▸ CDK9 P50750 5/20 0.44
▸ CDK7 P50613 6/20 0.42
▸ CCNH P51946 6/20 0.42
▸ MNAT1 P51948 5/20 0.42

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
SCHEMBL4925137 0.78 DYRK1A (0.57) CLK1CDK5CDK5R1MAP3K14CDK2
SCHEMBL24311837 0.75 MAP3K14 (0.47) CLK1CDK5CDK5R1MAP3K14CCNK
SCHEMBL25600700 0.71 CCNK (0.48) MAP3K14CCNKCDK12CCNT1CCNE1
SCHEMBL29488129 0.71 MAP3K14 (0.65) CLK1CDK5CDK5R1MAP3K14
SCHEMBL29488124 0.69 CLK1 (0.55) CLK1CDK5CDK5R1MAP3K14
SCHEMBL25600703 0.69 CLK1 (0.52) CLK1CDK5CDK5R1MAP3K14CCNK
SCHEMBL28817250 0.69 CCNK (0.48) CLK1CDK5CDK5R1MAP3K14CCNK
SCHEMBL21188782 0.69 CLK1 (0.43) CLK1CDK5CDK5R1MAP3K14CDK7
SCHEMBL25599273 0.69 CCNK (0.60) MAP3K14CCNKCDK12CCNT1CCNE1
SCHEMBL25599698 0.69 CDK7 (0.47) MAP3K14CCNKCDK12CCNT1CCNE1

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-3484871-B1 PIPERIDINE DERIVATIVES AS INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS INC (US) 2023-06-07 — — EP disclosed
US-20230000870-A1 METHODS OF TREATING CANCER IN BIOMARKER-IDENTIFIED PATIENTS WITH INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2023-01-05 — — 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 (1 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-20230000870-A1 METHODS OF TREATING CANCER IN BIOMARKER-IDENTIFIED PATIENTS WITH INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, RB1, MKI67 CLK1 835/4885CDK5 21/4885CDK5R1 37/4885

“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.

Send feedback