SCHEMBL15875738

SCHEMBL15875738

C[C@@H]1C[C@H](OC(N)=O)CN(c2ccncc2[N+](=O)[O-])C1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ CTPS1 P17812 1/20 0.39
▸ GAA P10253 1/20 0.36
▸ PIM2 Q9P1W9 9/20 0.36
▸ HPGD P15428 1/20 0.35
▸ PIM1 P11309 2/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ PIM3 Q86V86 1/20 0.35
▸ HTT P42858 1/20 0.34
▸ CSF1R P07333 1/20 0.34

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
SCHEMBL17254424 1.00 MAPT (0.43) MAPTALDH1A1LMNACTPS1GAA
SCHEMBL17254425 1.00 MAPT (0.43) MAPTALDH1A1LMNACTPS1GAA
SCHEMBL15874919 0.85 PIM2 (0.39) MAPTPIM2PIM1PIM3
SCHEMBL15874915 0.85 PIM2 (0.39) MAPTPIM2PIM1PIM3
SCHEMBL16515825 0.83 PIM2 (0.40) MAPTALDH1A1GAAPIM2PIM1
SCHEMBL16515822 0.83 PIM2 (0.40) MAPTALDH1A1GAAPIM2PIM1
SCHEMBL18259439 0.81 MAPT (0.46) MAPTALDH1A1LMNAPIM2PIM1
SCHEMBL13456916 0.81 MAPT (0.46) MAPTALDH1A1LMNAPIM2PIM1
SCHEMBL18284067 0.80 MAPT (0.37) MAPTALDH1A1LMNACTPS1GAA
SCHEMBL15913504 0.77 MAPT (0.42) MAPTALDH1A1LMNAPIM2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2943485-A1 BICYCLIC AROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS Incyte Corporation (US) 2015-11-18 — — EP disclosed
US-9187486-B2 Bicyclic pyridazine compounds as Pim inhibitors AMGEN INC. (US) 2015-11-17 — — US disclosed
WO-2014110574-A1 BICYCLIC AROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION (US) 2014-07-17 — — WO disclosed
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