SCHEMBL24022622

SCHEMBL24022622

CC(C)N1CCOc2c(F)cc(-c3nc(Nc4ccc(C5CCNCC5)c(F)c4F)ncc3F)cc21

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 20/20 0.80
▸ CDK6 Q00534 19/20 0.80
▸ CSF1R P07333 13/20 0.80
▸ CCNA2 P20248 3/20 0.67
▸ CDK2 P24941 3/20 0.67
▸ CCNK O75909 2/20 0.67
▸ CDK7 P50613 2/20 0.67
▸ CDK9 P50750 2/20 0.67
▸ CCNH P51946 2/20 0.67
▸ CDK5 Q00535 2/20 0.67
▸ CDK5R1 Q15078 2/20 0.67
▸ PIK3CD O00329 4/20 0.66
▸ CCNE1 P24864 1/20 0.64

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
SCHEMBL21245628 0.89 CDK4 (1.00) CDK4CDK6CSF1RCCNA2CDK2
SCHEMBL21245578 0.88 CDK4 (0.84) CDK4CDK6CSF1RCCNA2CDK2
SCHEMBL21267316 0.87 CDK4 (0.89) CDK4CDK6CSF1RCCNA2CDK2
SCHEMBL21245760 0.87 CDK4 (0.85) CDK4CDK6CSF1RCCNA2CDK2
Hydrochloric Acid SCHEMBL21245632 0.87 CDK4 (0.83) CDK4CDK6CSF1RCCNA2CDK2
SCHEMBL21245723 0.87 CDK6 (1.00) CDK4CDK6CSF1RCCNA2CDK2
SCHEMBL21245771 0.87 CDK4 (0.85) CDK4CDK6CSF1RCCNA2CDK2
SCHEMBL21245810 0.86 CDK4 (1.00) CDK4CDK6CSF1RCCNA2CDK2
SCHEMBL21245558 0.86 CDK4 (1.00) CDK4CDK6CSF1RCCNA2CDK2
Hydrochloric Acid SCHEMBL21245651 0.86 CDK4 (0.84) CDK4CDK6CSF1RCCNA2CDK2

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-11174252-B2 Heterocyclic compounds as kinase inhibitors NUVATION BIO INC. (US) 2021-11-16 — — 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-11174252-B2 Heterocyclic compounds as kinase inhibitors CDK6, CDK4, CDK9 CDK4 2/4885CDK6 1/4885CSF1R 3721/4885

“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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