SCHEMBL5582092

SCHEMBL5582092

c1ccc(C2(c3ccccc3)c3ccccc3Nc3cccc(-c4ccc(-c5cccc6c5C(c5ccccc5)(c5ccccc5)c5ccccc5N6)cc4)c32)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
CHRM2 P08172 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
KCNH2 Q12809 1/20 0.39
FLT3 P36888 2/20 0.36
MEN1 O00255 3/20 0.34
MAPT P10636 3/20 0.34
KMT2A Q03164 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 2/20 0.34
OPRK1 P41145 1/20 0.34
NOX1 Q9Y5S8 1/20 0.33
CFTR P13569 1/20 0.33
GOPC Q9HD26 1/20 0.33
PDGFRA P16234 1/20 0.32
FER P16591 1/20 0.32
LTK P29376 1/20 0.32
CDK8 P49336 1/20 0.32
ACVR1 Q04771 1/20 0.32
LRRK2 Q5S007 1/20 0.32

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
SCHEMBL5581522 0.98 LMNA (0.50) LMNACHRM2ADORA3KCNH2FLT3
SCHEMBL28164935 0.92 LMNA (0.45) LMNACHRM2ADORA3KCNH2FLT3
SCHEMBL5582199 0.90 LMNA (0.43) LMNACHRM2ADORA3KCNH2FLT3
SCHEMBL28310002 0.89 LMNA (0.49) LMNACHRM2ADORA3KCNH2MEN1
SCHEMBL22719989 0.89 LMNA (0.42) LMNACHRM2ADORA3KCNH2FLT3
SCHEMBL29373003 0.79 LMNA (0.69) LMNACHRM2ADORA3KCNH2MEN1
SCHEMBL2453350 0.79 LMNA (0.69) LMNACHRM2ADORA3KCNH2MEN1
SCHEMBL30259105 0.79 LMNA (0.44) LMNACHRM2ADORA3KCNH2MEN1
SCHEMBL25576166 0.78 LMNA (0.41) LMNAFLT3MEN1MAPTKMT2A
SCHEMBL25576170 0.78 PDK2 (0.48) LMNAPGRPDK2

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-1840120-B1 N-Heterocyclic compounds and their use in electronic, optoelectronic and electroluminiscent components NOVALED AG (DE) 2013-04-24 EP disclosed
EP-1840120-A1 N-Heterocyclic compounds and their use in electronic, optoelectronic and electroluminiscent components Novaled AG (DE) 2007-10-03 EP disclosed