SCHEMBL22164718

SCHEMBL22164718

N#Cc1cc2cnc(Nc3ccc(N4CCC(N5CCOCC5)CC4)c(F)c3)nc2n(C2CCCC2)c1=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 16/20 0.61
▸ CCND1 P24385 15/20 0.61
▸ CCNA2 P20248 11/20 0.61
▸ CDK2 P24941 11/20 0.61
▸ FGFR1 P11362 8/20 0.61
▸ CDK6 Q00534 4/20 0.61
▸ NUAK1 O60285 3/20 0.61
▸ CDK1 P06493 3/20 0.61
▸ CCNB1 P14635 3/20 0.61
▸ CCNE1 P24864 2/20 0.61
▸ CCNT1 O60563 2/20 0.61
▸ CSF1R P07333 2/20 0.61
▸ CDK9 P50750 2/20 0.61
▸ PIK3CD O00329 1/20 0.61
▸ PRKAB2 O43741 1/20 0.61
▸ ABL1 P00519 1/20 0.61
▸ FYN P06241 1/20 0.61
▸ RET P07949 1/20 0.61
▸ PDGFRB P09619 1/20 0.61
▸ MARK3 P27448 1/20 0.61

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
SCHEMBL22165073 0.95 CDK4 (0.65) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL22164925 0.91 CDK4 (0.70) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL22165039 0.89 CDK4 (0.76) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL22171319 0.89 CDK4 (0.59) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL29507838 0.88 CDK4 (0.63) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL22860486 0.88 CDK4 (0.63) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL22165045 0.87 CDK4 (0.64) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL22164902 0.87 CDK4 (0.78) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL22164819 0.87 CDK4 (0.65) CDK4CCND1CCNA2CDK2FGFR1
SCHEMBL29507767 0.87 CDK4 (0.65) CDK4CCND1CCNA2CDK2FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220220103-A1 CYCLIN-DEPENDENT KINASE INHIBITORS SPV THERAPEUTICS INC. 2022-07-14 — — US claimed
WO-2020140053-A1 CYCLIN-DEPENDENT KINASE INHIBITORS SPV THERAPEUTICS INC. (US) 2020-07-02 — — WO claimed
US-20220220103-A1 CYCLIN-DEPENDENT KINASE INHIBITORS SPV THERAPEUTICS INC. 2022-07-14 — — US disclosed
US-20220220103-A1 CYCLIN-DEPENDENT KINASE INHIBITORS SPV THERAPEUTICS INC. 2022-07-14 — — US disclosed
WO-2020140053-A1 CYCLIN-DEPENDENT KINASE INHIBITORS SPV THERAPEUTICS INC. (US) 2020-07-02 — — WO disclosed
WO-2020140053-A1 CYCLIN-DEPENDENT KINASE INHIBITORS SPV THERAPEUTICS INC. (US) 2020-07-02 — — WO 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-20220220103-A1 CYCLIN-DEPENDENT KINASE INHIBITORS CDK2, CDK1, CCNK CDK4 9/4885CCND1 51/4885CCNA2 34/4885

“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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