SCHEMBL19371102

SCHEMBL19371102

CC1CC(NC(=O)OC(C)(C)C)CN(c2ccncc2N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF2AK4 Q9P2K8 1/20 0.46
AURKA O14965 1/20 0.42
PDPK1 O15530 1/20 0.42
AURKB Q96GD4 1/20 0.42
PDE10A Q9Y233 3/20 0.37
KDM4D Q6B0I6 6/20 0.36
JAK2 O60674 2/20 0.36
JAK1 P23458 2/20 0.36
PIM1 P11309 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
CKS1B P61024 1/20 0.35
SKP1 P63208 1/20 0.35
SKP2 Q13309 1/20 0.35
EPHX2 P34913 1/20 0.35
JAK3 P52333 1/20 0.35
BTK Q06187 1/20 0.35
KDM6A O15550 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 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
SCHEMBL19371330 1.00 EIF2AK4 (0.46) EIF2AK4AURKAPDPK1AURKBPDE10A
SCHEMBL15932915 0.84 EIF2AK4 (0.48) EIF2AK4AURKAPDPK1AURKBPDE10A
SCHEMBL2836323 0.84 EIF2AK4 (0.48) EIF2AK4AURKAPDPK1AURKBPDE10A
SCHEMBL11912156 0.84 EIF2AK4 (0.48) EIF2AK4AURKAPDPK1AURKBPDE10A
SCHEMBL15932916 0.84 EIF2AK4 (0.48) EIF2AK4AURKAPDPK1AURKBPDE10A
SCHEMBL11912148 0.84 EIF2AK4 (0.48) EIF2AK4AURKAPDPK1AURKBPDE10A
SCHEMBL2836325 0.84 EIF2AK4 (0.48) EIF2AK4AURKAPDPK1AURKBPDE10A
SCHEMBL19371088 0.83 EIF2AK4 (0.47) EIF2AK4AURKAPDPK1AURKBPIM1
SCHEMBL15535908 0.83 NFKB1 (0.34) PDE10AKDM4DCKS1BSKP1SKP2
SCHEMBL15535236 0.83 EIF2AK4 (0.36) EIF2AK4PIM1PIM3PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2943485-B1 BICYCLIC AROMATIC CARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS INCYTE HOLDINGS CORP (US) 2017-09-20 EP disclosed