SCHEMBL19024561

SCHEMBL19024561

CC(C)(C)OC(=O)N(Cc1ccc(NC(=O)O)cn1)[C@H]1CCC[C@@H](Nc2ncc(Cl)c(-c3cn(S(=O)(=O)c4ccccc4)c4ccccc34)n2)C1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CDK7 P50613 14/20 0.39
▸ CCNT1 O60563 13/20 0.39
▸ CDK9 P50750 13/20 0.39
▸ CCNH P51946 13/20 0.39
▸ MNAT1 P51948 10/20 0.39
▸ CCNK O75909 8/20 0.39
▸ CDK12 Q9NYV4 8/20 0.39
▸ CDK2 P24941 6/20 0.38
▸ CDK13 Q14004 6/20 0.38
▸ CCNA2 P20248 5/20 0.38
▸ RPS6KA3 P51812 1/20 0.38
▸ EGFR P00533 3/20 0.38
▸ HTR6 P50406 3/20 0.38
▸ CCNE1 P24864 1/20 0.38

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
SCHEMBL17150634 0.93 CCNT1 (0.38) CDK7CCNT1CDK9CCNHMNAT1
SCHEMBL16654674 0.88 CDK7 (0.44) CDK7CCNT1CDK9CCNHMNAT1
SCHEMBL16655024 0.84 CDK7 (0.44) CDK7CCNT1CDK9CCNHMNAT1
SCHEMBL17150661 0.81 MAPK8 (0.42) CDK7CCNT1CDK9CCNHMNAT1
SCHEMBL19024554 0.81 CDK7 (0.49) CDK7CCNT1CDK9CCNHMNAT1
SCHEMBL19024481 0.81 HTR6 (0.47) CDK7CCNT1CDK9CCNHMNAT1
SCHEMBL19024570 0.81 CDK7 (0.38) CDK7CCNT1CDK9CCNHMNAT1
SCHEMBL20412340 0.81 CDK7 (0.47) CDK7CCNT1CDK9CCNHMNAT1
SCHEMBL16665090 0.81 CDK7 (0.47) CDK7CCNT1CDK9CCNHMNAT1
SCHEMBL17688399 0.81 CDK7 (0.43) CDK7CCNT1CDK9CCNHMNAT1

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-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

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-20180208578-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 CDK7 1/4885CCNT1 34/4885CDK9 3/4885
US-20170183355-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 CDK7 1/4885CCNT1 34/4885CDK9 3/4885

“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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