SCHEMBL11981033

SCHEMBL11981033

Cc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccc(C)cc6)ccc4n5-c4cccc(-c5ccccn5)c4)ccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 11/20 0.49
NPY5R Q15761 1/20 0.42
HTR1A P08908 1/20 0.42
HTR7 P34969 1/20 0.42
MCL1 Q07820 1/20 0.41
FLT3 P36888 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.37
NPC1 O15118 1/20 0.36
MITF O75030 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
TGFBR1 P36897 1/20 0.36

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
SCHEMBL16901210 0.92 GRM5 (0.45) GRM5NPY5RHTR1AHTR7MCL1
SCHEMBL16902187 0.92 KDM4E (0.46) GRM5NPY5RHTR1AHTR7MCL1
SCHEMBL19961383 0.90 NPY5R (0.43) GRM5NPY5RHTR1AHTR7MCL1
SCHEMBL25671789 0.90 GRM5 (0.45) GRM5NPY5RHTR1AHTR7KDM4E
SCHEMBL15034570 0.88 HTR1A (0.43) GRM5NPY5RHTR1AHTR7MCL1
SCHEMBL14733874 0.88 HTR1A (0.45) GRM5NPY5RHTR1AHTR7KDM4E
SCHEMBL13471431 0.88 KDM4E (0.47) GRM5NPY5RHTR1AHTR7MCL1
SCHEMBL14733832 0.88 HTR1A (0.44) GRM5NPY5RHTR1AHTR7MCL1
SCHEMBL18701159 0.88 HTR1A (0.49) GRM5NPY5RHTR1AHTR7MCL1
SCHEMBL13471351 0.87 HTR1A (0.50) GRM5HTR1AHTR7IRAK4

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
US-9306174-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2016-04-05 US disclosed
US-9306175-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2016-04-05 US disclosed
US-20120273767-A1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2012-11-01 US disclosed
US-20120205642-A1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD (JP) 2012-08-16 US disclosed