SCHEMBL12854007

SCHEMBL12854007

Cc1ccccc1-n1c(-c2ccccc2-c2ccccc2-c2ccccc2-c2ccccc2-c2nc3cccnc3n2-c2ccccc2C)nc2cccnc21

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 11/20 0.51
AKT2 P31751 5/20 0.51
AKT3 Q9Y243 3/20 0.47
TSHR P16473 1/20 0.45
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PDE2A O00408 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TP53 P04637 1/20 0.41
PDE4B Q07343 2/20 0.39
PDE4D Q08499 1/20 0.39
RAB9A P51151 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
SCHEMBL13052947 0.93 AKT1 (0.49) AKT1AKT2AKT3TSHRALDH1A1
SCHEMBL13052968 0.91 AKT1 (0.48) AKT1AKT2AKT3TSHRALDH1A1
SCHEMBL12854088 0.91 AKT1 (0.44) AKT1AKT2AKT3TSHRPDE2A
SCHEMBL12854026 0.90 AKT1 (0.44) AKT1AKT2AKT3TSHRALDH1A1
SCHEMBL804796 0.90 AKT1 (0.47) AKT1AKT2AKT3TSHRALDH1A1
SCHEMBL25635133 0.89 AKT1 (0.52) AKT1AKT2AKT3LMNAPDE2A
SCHEMBL12750208 0.89 AKT1 (0.47) AKT1AKT2AKT3TSHRALDH1A1
SCHEMBL13052965 0.87 AKT1 (0.45) AKT1AKT2AKT3TSHRALDH1A1
SCHEMBL804993 0.87 TSHR (0.46) AKT1AKT2AKT3TSHRALDH1A1
SCHEMBL13052976 0.87 TSHR (0.46) AKT1AKT2AKT3TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120298979-A1 ORGANIC ELECTROLUMINESCENT DEVICE UDC IRELAND LIMITED (IE) 2012-11-29 US disclosed
US-20120298979-A1 ORGANIC ELECTROLUMINESCENT DEVICE UDC IRELAND LIMITED (IE) 2012-11-29 US disclosed
US-8277954-B2 Light emitting compound; high luminescence efficiency; durability FUJIFILM CORPORATION (JP) 2012-10-02 US disclosed
US-8277954-B2 Light emitting compound; high luminescence efficiency; durability FUJIFILM CORPORATION (JP) 2012-10-02 US disclosed
US-20070196692-A1 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2007-08-23 US disclosed
US-20070196692-A1 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2007-08-23 US disclosed