SCHEMBL19024481

SCHEMBL19024481

CC(=O)N(CC1CCN(C(=O)OC(C)(C)C)CC1)[C@H]1CCC[C@@H](Nc2ncc(Cl)c(-c3cn(S(=O)(=O)c4ccccc4)c4ccccc34)n2)C1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 4/20 0.47
▸ MAPK8 P45983 10/20 0.42
▸ MAPK9 P45984 10/20 0.42
▸ MAPK10 P53779 7/20 0.42
▸ CCNT1 O60563 4/20 0.41
▸ CDK9 P50750 4/20 0.41
▸ CDK7 P50613 3/20 0.41
▸ CCNH P51946 3/20 0.41
▸ MNAT1 P51948 3/20 0.41
▸ BCHE P06276 1/20 0.41
▸ CDK2 P24941 11/20 0.39
▸ JUN P05412 9/20 0.39
▸ CCNE1 P24864 2/20 0.39
▸ EGFR P00533 2/20 0.38
▸ CCNK O75909 1/20 0.37
▸ CDK12 Q9NYV4 1/20 0.37

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
SCHEMBL19054722 0.93 HTR6 (0.46) HTR6MAPK8MAPK9MAPK10CCNT1
SCHEMBL19040131 0.93 HTR6 (0.46) HTR6MAPK8MAPK9MAPK10CCNT1
SCHEMBL17150661 0.90 MAPK8 (0.42) HTR6MAPK8MAPK9MAPK10CCNT1
SCHEMBL19054721 0.88 HTR6 (0.48) HTR6MAPK8MAPK9MAPK10CCNT1
SCHEMBL19024572 0.88 HTR6 (0.48) HTR6MAPK8MAPK9MAPK10CCNT1
SCHEMBL16655095 0.86 HTR6 (0.55) HTR6MAPK8MAPK9MAPK10CCNT1
SCHEMBL19054664 0.86 HTR6 (0.48) HTR6MAPK8MAPK9MAPK10CCNT1
SCHEMBL17150647 0.86 HTR6 (0.48) HTR6MAPK8MAPK9MAPK10CCNT1
SCHEMBL19024741 0.86 HTR6 (0.48) HTR6MAPK8MAPK9MAPK10CCNT1
SCHEMBL19024540 0.86 HTR6 (0.49) HTR6MAPK8MAPK9MAPK10CCNT1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3489232-A2 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) Syros Pharmaceuticals, Inc. (US) 2019-05-29 — — EP disclosed
US-20180319772-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2018-11-08 — — US disclosed
US-10106526-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2018-10-23 — — US disclosed
US-10059690-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2018-08-28 — — US disclosed
US-20180208578-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2018-07-26 — — US disclosed
US-20180208578-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2018-07-26 — — US disclosed
US-20180208578-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2018-07-26 — — US disclosed
US-20170183355-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2017-06-29 — — US disclosed
US-20170183355-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2017-06-29 — — US disclosed
US-20170183355-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2017-06-29 — — 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 (5 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-10059690-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) CDK7, CDK3, CDK9 HTR6 3416/4885MAPK8 193/4885MAPK9 142/4885
US-10106526-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) CDK7, CDK3, CDK9 HTR6 3416/4885MAPK8 193/4885MAPK9 142/4885
US-20180208578-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 HTR6 3416/4885MAPK8 193/4885MAPK9 142/4885
US-20180319772-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 HTR6 3416/4885MAPK8 193/4885MAPK9 142/4885
US-20170183355-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 HTR6 3416/4885MAPK8 193/4885MAPK9 142/4885

“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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