SCHEMBL19600385

SCHEMBL19600385

Cc1cnc(N[C@@H]2CCC[C@](C)(NC(=O)c3ccc(N)c(F)c3)C2)nc1-c1n[nH]c2c(C)cccc12

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CDK7 P50613 7/20 0.45
▸ CCNT1 O60563 12/20 0.44
▸ CCNK O75909 12/20 0.44
▸ CDK9 P50750 12/20 0.44
▸ CDK12 Q9NYV4 12/20 0.44
▸ CDK2 P24941 11/20 0.44
▸ CCNE1 P24864 10/20 0.44
▸ CCNH P51946 5/20 0.44
▸ MNAT1 P51948 5/20 0.44
▸ MCHR1 Q99705 2/20 0.38
▸ ADRA2A P08913 1/20 0.37
▸ ADRA1A P35348 1/20 0.37
▸ HRH1 P35367 1/20 0.37
▸ HTR2B P41595 1/20 0.37
▸ ABL1 P00519 1/20 0.36

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
SCHEMBL19605656 0.93 CCNK (0.48) CDK7CCNT1CCNKCDK9CDK12
SCHEMBL19600383 0.92 CCNT1 (0.43) CDK7CCNT1CCNKCDK9CDK12
SCHEMBL19600367 0.92 CDK7 (0.49) CDK7CCNT1CCNKCDK9CDK12
SCHEMBL19605708 0.85 CCNK (0.47) CDK7CCNT1CCNKCDK9CDK12
SCHEMBL17688431 0.84 CCNT1 (0.58) CDK7CCNT1CCNKCDK9CDK12
SCHEMBL19600378 0.83 CDK7 (0.47) CDK7CCNT1CCNKCDK9CDK12
SCHEMBL17688397 0.83 CCNK (0.54) CDK7CCNT1CCNKCDK9CDK12
SCHEMBL19600376 0.79 CCNK (0.42) CDK7CCNT1CCNKCDK9CDK12
SCHEMBL19600381 0.78 CCNK (0.47) CDK7CCNT1CCNKCDK9CDK12
SCHEMBL17688384 0.77 CCNT1 (0.57) CDK7CCNT1CCNKCDK9CDK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170327496-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) OXFORD FINANCE LLC, AS COLLATERAL AGENT 2017-11-16 — — 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-20170327496-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) CDK7, CDK3, CDK9 CDK7 1/4885CCNT1 33/4885CCNK 6/4885

“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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