SCHEMBL12079745

SCHEMBL12079745

C[C@@H]1C[C@H](c2ccncc2NC(=O)c2ccc(F)c(-c3c(F)cc(C4(O)CCCC4)cc3F)n2)C[C@H](O)[C@@]1(C)O

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PIM2 Q9P1W9 20/20 0.68
▸ PIM1 P11309 19/20 0.68
▸ PIM3 Q86V86 19/20 0.68
▸ GSK3B P49841 1/20 0.57

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
SCHEMBL12079759 1.00 PIM2 (0.68) PIM2PIM1PIM3GSK3B
SCHEMBL12081282 0.98 PIM2 (0.70) PIM2PIM1PIM3GSK3B
SCHEMBL12079865 0.94 PIM1 (0.71) PIM2PIM1PIM3
SCHEMBL12092841 0.93 PIM2 (0.64) PIM2PIM1PIM3GSK3B
SCHEMBL12092851 0.93 PIM2 (0.64) PIM2PIM1PIM3GSK3B
SCHEMBL12079470 0.92 PIM1 (0.72) PIM2PIM1PIM3GSK3B
SCHEMBL12079473 0.90 PIM1 (0.74) PIM2PIM1PIM3GSK3B
SCHEMBL12080992 0.88 PIM2 (0.71) PIM2PIM1PIM3
SCHEMBL15947839 0.88 PIM2 (0.78) PIM2PIM1PIM3GSK3B
SCHEMBL12079758 0.88 PIM2 (0.78) PIM2PIM1PIM3GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140228363-A1 TETRASUBSTITUTED CYCLOHEXYL COMPOUNDS AS KINASE INHIBITORS NOVARTIS AG (CH) 2014-08-14 — — US disclosed
US-20140228363-A1 TETRASUBSTITUTED CYCLOHEXYL COMPOUNDS AS KINASE INHIBITORS NOVARTIS AG (CH) 2014-08-14 — — US disclosed
US-20120225061-A1 TETRASUBSTITUTED CYCLOHEXYL COMPOUNDS AS KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-09-06 — — US disclosed
US-20120225061-A1 TETRASUBSTITUTED CYCLOHEXYL COMPOUNDS AS 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 (2 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-20140228363-A1 TETRASUBSTITUTED CYCLOHEXYL COMPOUNDS AS KINASE INHIBITORS PIM1, PIM2, PIM3 PIM2 2/4885PIM1 1/4885PIM3 3/4885
US-20120225061-A1 TETRASUBSTITUTED CYCLOHEXYL COMPOUNDS AS KINASE INHIBITORS PIM1, PIM2, PIM3 PIM2 2/4885PIM1 1/4885PIM3 3/4885

“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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