SCHEMBL30853845

SCHEMBL30853845

Cc1noc(C)c1-c1ccc2c(-c3nc(N[C@H]4CCC[C@H]4O)ncc3C(F)(F)F)cn(COCC[Si](C)(C)C)c2c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CCNK O75909 11/20 0.47
▸ CDK12 Q9NYV4 11/20 0.47
▸ CDK7 P50613 10/20 0.47
▸ CCNH P51946 10/20 0.47
▸ CCNT1 O60563 9/20 0.47
▸ CDK9 P50750 9/20 0.47
▸ CCNE1 P24864 8/20 0.47
▸ CDK2 P24941 8/20 0.47
▸ MNAT1 P51948 7/20 0.40
▸ LRRK2 Q5S007 1/20 0.39
▸ DGAT1 O75907 3/20 0.36
▸ CDK4 P11802 1/20 0.35
▸ CCND1 P24385 1/20 0.35
▸ CCND3 P30281 1/20 0.35
▸ CDK6 Q00534 1/20 0.35
▸ BRD4 O60885 1/20 0.34

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
SCHEMBL21184312 1.00 CCNK (0.47) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL21184427 0.91 CCNK (0.47) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL21184297 0.89 CDK7 (0.44) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL21178909 0.89 CDK7 (0.44) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL21184423 0.89 CCNK (0.54) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL21184315 0.89 CDK7 (0.45) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL21184310 0.87 CDK7 (0.43) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL24176607 0.86 CCNK (0.44) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL21184416 0.85 CDK7 (0.49) CCNKCDK12CDK7CCNHCCNT1
SCHEMBL21178882 0.85 CCNT1 (0.42) CCNKCDK12CDK7CCNHCCNT1

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-11918592-B2 Inhibitors of cyclin dependent kinase 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2024-03-05 — — 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-11918592-B2 Inhibitors of cyclin dependent kinase 7 (CDK7) CDK7, CDK3, CCNK CCNK 3/4885CDK12 27/4885CDK7 1/4885

“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.

Send feedback