SCHEMBL21178619

SCHEMBL21178619

Cc1noc(C)c1-c1ccc2c(-c3nc(S(C)(=O)=O)ncc3C(F)(F)F)nn(C3CCCCO3)c2n1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 3/20 0.39
CCNK O75909 3/20 0.39
CCNE1 P24864 3/20 0.39
CDK2 P24941 3/20 0.39
CDK7 P50613 3/20 0.39
CDK9 P50750 3/20 0.39
CCNH P51946 3/20 0.39
CDK12 Q9NYV4 3/20 0.39
PDE5A O76074 1/20 0.33
ATR Q13535 4/20 0.32
MTOR P42345 1/20 0.31
BRD4 O60885 1/20 0.30

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
SCHEMBL30771929 1.00 CCNT1 (0.39) CCNT1CCNKCCNE1CDK2CDK7
SCHEMBL21178399 0.88 ATR (0.31) CCNT1CCNKCCNE1CDK2CDK7
SCHEMBL21178781 0.87 CCNT1 (0.40) CCNT1CCNKCCNE1CDK2CDK7
SCHEMBL24176486 0.86 ATR (0.34) CCNT1CCNKCCNE1CDK2CDK7
SCHEMBL21178566 0.82 CDK7 (0.39) CCNT1CCNKCCNE1CDK2CDK7
SCHEMBL24087427 0.81 CCNT1 (0.39) CCNT1CCNKCCNE1CDK2CDK7
SCHEMBL21188540 0.81 CCNK (0.65) CCNT1CCNKCCNE1CDK2CDK7
SCHEMBL24087463 0.81 CCNK (0.52) CCNT1CCNKCCNE1CDK2CDK7
SCHEMBL21178313 0.79 CCNE1 (0.47) CCNT1CCNKCCNE1CDK2CDK7
SCHEMBL21178938 0.78 CCNT1 (0.42) CCNT1CCNKCCNE1CDK2CDK7

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 7 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
EP-3740207-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) Syros Pharmaceuticals, Inc. (US) 2020-11-25 EP disclosed
EP-3740206-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) Syros Pharmaceuticals, Inc. (US) 2020-11-25 EP disclosed
WO-2019143730-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2019-07-25 WO disclosed
WO-2019143719-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2019-07-25 WO disclosed
WO-2019143719-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2019-07-25 WO 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 CCNT1 35/4885CCNK 3/4885CCNE1 48/4885
US-20210379065-A1 INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CCNK CCNT1 35/4885CCNK 3/4885CCNE1 48/4885

“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.