SCHEMBL22115126

SCHEMBL22115126

CC1(C)CC[C@H](Nc2ncc(C(F)(F)F)c(-c3c[nH]c4ccccc34)n2)CN1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CDK7 P50613 16/20 1.00
▸ CCNH P51946 16/20 1.00
▸ CCNK O75909 14/20 1.00
▸ CDK12 Q9NYV4 14/20 1.00
▸ CCNE1 P24864 13/20 1.00
▸ CDK2 P24941 13/20 1.00
▸ CCNT1 O60563 12/20 1.00
▸ CDK9 P50750 12/20 1.00
▸ MNAT1 P51948 14/20 0.78
▸ CYP2D6 P10635 1/20 0.62

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
SCHEMBL29498451 1.00 CDK7 (1.00) CDK7CCNHCCNKCDK12CCNE1
SCHEMBL24840707 0.90 CCNK (1.00) CDK7CCNHCCNKCDK12CCNE1
SCHEMBL24839622 0.88 CCNK (1.00) CDK7CCNHCCNKCDK12CCNE1
SCHEMBL25602824 0.87 CDK7 (0.77) CDK7CCNHCCNKCDK12CCNE1
SCHEMBL22115128 0.86 CCNK (1.00) CDK7CCNHCCNKCDK12CCNE1
SCHEMBL25329327 0.84 CDK7 (0.89) CDK7CCNHCCNKCDK12CCNE1
SCHEMBL25329325 0.84 CDK7 (0.89) CDK7CCNHCCNKCDK12CCNE1
SCHEMBL30203920 0.84 CCNE1 (1.00) CDK7CCNHCCNKCDK12CCNE1
SCHEMBL22115125 0.84 CCNE1 (1.00) CDK7CCNHCCNKCDK12CCNE1
SCHEMBL25597252 0.84 CCNE1 (1.00) CDK7CCNHCCNKCDK12CCNE1

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 5 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
US-20210401859-A1 METHODS OF TREATING CANCER IN BIOMARKER-IDENTIFIED PATIENTS WITH NON-COVALENT INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS INC (US) 2021-12-30 — — US disclosed
US-10738067-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2020-08-11 — — US disclosed
US-20200190126-A1 Inhibitors of Cyclin-Dependent Kinase 7 (CDK7) MEDIC LIFE SCIENCES, INC. 2020-06-18 — — 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 (4 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 CDK7 1/4885CCNH 17/4885CCNK 10/4885
US-10738067-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) CDK7, CDK1, CDK17 CDK7 1/4885CCNH 33/4885CCNK 8/4885
US-20210401859-A1 METHODS OF TREATING CANCER IN BIOMARKER-IDENTIFIED PATIENTS WITH NON-COVALENT INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK4, RB1 CDK7 1/4885CCNH 22/4885CCNK 13/4885
US-20200190126-A1 Inhibitors of Cyclin-Dependent Kinase 7 (CDK7) CDK7, CDK1, CDK17 CDK7 1/4885CCNH 33/4885CCNK 8/4885

“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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