SCHEMBL2184264

SCHEMBL2184264

NC1CN(c2ccnc3ccc(-c4cccc(-c5c(F)cccc5F)n4)cc23)CCC1O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIM2 Q9P1W9 16/20 0.49
PIM1 P11309 13/20 0.49
PIM3 Q86V86 9/20 0.49
SSTR2 P30874 1/20 0.41
SSTR4 P31391 1/20 0.41
KCNH2 Q12809 1/20 0.41
NSD2 O96028 1/20 0.39
PIK3CA P42336 2/20 0.39
CYP2C19 P33261 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
SCHEMBL2185217 1.00 PIM2 (0.49) PIM2PIM1PIM3SSTR2SSTR4
SCHEMBL2184956 0.91 PIM1 (0.49) PIM2PIM1PIM3SSTR2SSTR4
SCHEMBL2184958 0.91 PIM1 (0.49) PIM2PIM1PIM3SSTR2SSTR4
SCHEMBL2185190 0.86 PIM1 (0.50) PIM2PIM1PIM3KCNH2PIK3CA
SCHEMBL2185185 0.86 PIM1 (0.50) PIM2PIM1PIM3KCNH2PIK3CA
SCHEMBL2184916 0.84 PIM2 (0.42) PIM2PIM1PIM3SSTR2SSTR4
SCHEMBL12391074 0.80 PIM2 (0.53) PIM2PIM1PIM3KCNH2
SCHEMBL2184907 0.80 PIM2 (0.53) PIM2PIM1PIM3KCNH2
SCHEMBL2184908 0.80 PIM2 (0.53) PIM2PIM1PIM3KCNH2
SCHEMBL2186093 0.78 PIM1 (0.48) PIM2PIM1PIM3KCNH2PIK3CA

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-2342190-A1 BICYCLIC KINASE INHIBITORS Novartis AG (CH) 2011-07-13 EP claimed
WO-2010026121-A1 BICYCLIC KINASE INHIBITORS NOVARTIS AG (CH) 2010-03-11 WO claimed