SCHEMBL15818304

SCHEMBL15818304

CO[C@@H]1[C@H](C)C[C@@H](c2ccncc2N)C[C@@H]1NC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 19/20 0.45
▸ PIM3 Q86V86 19/20 0.45
▸ PIM2 Q9P1W9 19/20 0.45
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ GAA P10253 1/20 0.39

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
SCHEMBL15818305 1.00 PIM1 (0.45) PIM1PIM3PIM2KDM4EALDH1A1
SCHEMBL17272981 1.00 PIM1 (0.45) PIM1PIM3PIM2KDM4EALDH1A1
SCHEMBL17272982 1.00 PIM1 (0.45) PIM1PIM3PIM2KDM4EALDH1A1
SCHEMBL15817952 0.88 PIM1 (0.44) PIM1PIM3PIM2
SCHEMBL15817954 0.88 PIM1 (0.44) PIM1PIM3PIM2
SCHEMBL15589000 0.87 PIM1 (0.41) PIM1PIM3PIM2
SCHEMBL15589065 0.87 PIM1 (0.41) PIM1PIM3PIM2
SCHEMBL15589067 0.87 PIM1 (0.41) PIM1PIM3PIM2
SCHEMBL15588999 0.87 PIM1 (0.41) PIM1PIM3PIM2
SCHEMBL15557301 0.85 PIM1 (0.49) 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
EP-2935270-A1 ARYL-SUBSTITUTED FUSED BICYCLIC PYRIDAZINE COMPOUNDS Novartis AG (CH) 2015-10-28 — — EP disclosed
WO-2014099880-A1 ARYL-SUBSTITUTED FUSED BICYCLIC PYRIDAZINE COMPOUNDS NOVARTIS AG (CH) 2014-06-26 — — WO disclosed
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