SCHEMBL12077606

SCHEMBL12077606

C[C@@H]1C[C@H](N)C[C@H](c2ccncc2NC(=O)c2ccc(F)c(-c3c(F)cc(C4CCS(=O)(=O)CC4)cc3F)n2)C1

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 20/20 0.78
▸ PIM3 Q86V86 20/20 0.78
▸ PIM2 Q9P1W9 20/20 0.78
▸ GSK3B P49841 1/20 0.75
▸ PRKCQ Q04759 1/20 0.75
▸ KCNH2 Q12809 1/20 0.75
▸ PKN1 Q16512 1/20 0.75

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
SCHEMBL12697055 0.96 PIM1 (0.73) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL12077609 0.94 PIM1 (0.78) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL12077755 0.91 PIM2 (0.80) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL12077751 0.91 PIM2 (0.80) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL12077299 0.89 PIM2 (0.90) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL12077297 0.89 PIM2 (0.90) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL12077949 0.89 PIM2 (0.81) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL12077947 0.89 PIM2 (0.81) PIM1PIM3PIM2GSK3BPRKCQ
SCHEMBL12078527 0.88 PIM1 (0.83) PIM1PIM3PIM2
SCHEMBL12077170 0.88 PIM1 (0.83) PIM1PIM3PIM2

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-20120225062-A1 NOVEL KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-09-06 — — US disclosed
US-20120225062-A1 NOVEL KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-09-06 — — 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-20120225062-A1 NOVEL KINASE INHIBITORS PIM1, PIM2, PIM3 PIM1 1/4885PIM3 3/4885PIM2 2/4885

“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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