SCHEMBL16515822

SCHEMBL16515822

C[C@@H]1C[C@H](OC(N)=O)CN(c2ccncc2N)C1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PIM2 Q9P1W9 15/20 0.40
▸ GAA P10253 2/20 0.40
▸ MAPT P10636 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ PIM1 P11309 5/20 0.37
▸ PIM3 Q86V86 2/20 0.37

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
SCHEMBL16515825 1.00 PIM2 (0.40) PIM2GAAMAPTKDM4EALDH1A1
SCHEMBL15875738 0.83 MAPT (0.43) PIM2GAAMAPTALDH1A1PIM1
SCHEMBL17254425 0.83 MAPT (0.43) PIM2GAAMAPTALDH1A1PIM1
SCHEMBL17254424 0.83 MAPT (0.43) PIM2GAAMAPTALDH1A1PIM1
SCHEMBL15875059 0.83 PIM2 (0.43) PIM2PIM1PIM3
SCHEMBL15875056 0.83 PIM2 (0.43) PIM2PIM1PIM3
SCHEMBL16525750 0.82 MAPT (0.49) PIM2GAAMAPTPIM1PIM3
SCHEMBL16515786 0.81 MAPT (0.40) PIM2GAAMAPTKDM4EALDH1A1
SCHEMBL16515549 0.81 MAPT (0.40) PIM2GAAMAPTKDM4EALDH1A1
SCHEMBL16515552 0.81 MAPT (0.40) PIM2GAAMAPTKDM4EALDH1A1

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
WO-2016196244-A1 PYRIDINEAMINE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION (US) 2016-12-08 — — WO disclosed
EP-3036238-A1 FURO- AND THIENO-PYRIDINE CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS Incyte Corporation (US) 2016-06-29 — — EP disclosed
WO-2016010897-A1 BICYCLIC HETEROAROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION (US) 2016-01-21 — — WO disclosed
WO-2015027124-A1 FURO- AND THIENO-PYRIDINE CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE CORPORATION (US) 2015-02-26 — — WO disclosed
Send feedback