SCHEMBL16698700

SCHEMBL16698700

C[C@H]1C[C@@H](c2ccncc2N)C[C@@H](NC(=O)O)[C@H]1OCCC#N

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PIM2 Q9P1W9 19/20 0.51
▸ PIM1 P11309 19/20 0.51
▸ PIM3 Q86V86 18/20 0.51

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
SCHEMBL16698701 1.00 PIM2 (0.51) PIM2PIM1PIM3
SCHEMBL15588718 0.89 PIM2 (0.47) PIM2PIM1PIM3
SCHEMBL15588717 0.89 PIM2 (0.47) PIM2PIM1PIM3
SCHEMBL15817952 0.87 PIM1 (0.44) PIM2PIM1PIM3
SCHEMBL15817954 0.87 PIM1 (0.44) PIM2PIM1PIM3
SCHEMBL16587819 0.86 PIM2 (0.49) PIM2PIM1PIM3
SCHEMBL17272976 0.86 PIM1 (0.49) PIM2PIM1PIM3
SCHEMBL17272975 0.86 PIM1 (0.49) PIM2PIM1PIM3
SCHEMBL15557301 0.86 PIM1 (0.49) PIM2PIM1PIM3
SCHEMBL17272967 0.85 PIM2 (0.43) PIM2PIM1PIM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2861585-B1 NOVEL RING-SUBSTITUTED N-PYRIDINYL AMIDES AS KINASE INHIBITORS NOVARTIS AG (CH) 2019-01-09 — — EP disclosed
US-20150336960-A1 ARYL-SUBSTITUTED FUSED BICYCLIC PYRIDAZINE COMPOUNDS NOVARTIS AG (CH) 2015-11-26 — — US disclosed
US-9173883-B2 Ring-substituted N-pyridinyl amides as kinase inhibitors NOVARTIS AG (CH) 2015-11-03 — — US disclosed
US-20150150873-A1 NOVEL RING-SUBSTITUTED N-PYRIDINYL AMIDES AS KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2015-06-04 — — US disclosed
US-20150133473-A1 NOVEL RING-SUBSTITUTED N-PYRIDINYL AMIDES AS KINASE INHIBITORS NOVARTIS AG (CH) 2015-05-14 — — 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 (3 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-20150133473-A1 NOVEL RING-SUBSTITUTED N-PYRIDINYL AMIDES AS KINASE INHIBITORS PIM1, PIM2, MAP3K1 PIM2 2/4885PIM1 1/4885PIM3 4/4885
US-20150150873-A1 NOVEL RING-SUBSTITUTED N-PYRIDINYL AMIDES AS KINASE INHIBITORS PIM1, PIM2, MAP3K1 PIM2 2/4885PIM1 1/4885PIM3 4/4885
US-20150336960-A1 ARYL-SUBSTITUTED FUSED BICYCLIC PYRIDAZINE COMPOUNDS 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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