SCHEMBL10112906

SCHEMBL10112906

N#Cc1c(Cl)cccc1Oc1ccc(C2(c3ccc(Oc4cccc(Cl)c4C#N)cc3)CC3CCC2C3)cc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 15/20 0.46
TLR8 Q9NR97 1/20 0.43
MAPT P10636 1/20 0.43
HSD11B1 P28845 1/20 0.40
EZH2 Q15910 1/20 0.36
BCL2L1 Q07817 1/20 0.36
MCL1 Q07820 1/20 0.36
ALOX5 P09917 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
SCHEMBL10112892 0.82 TLR8 (0.47) TLR8MAPTHSD11B1EZH2BCL2L1
SCHEMBL10112898 0.79 TLR8 (0.46) TLR8MAPTHSD11B1EZH2BCL2L1
SCHEMBL10129669 0.79 ALOX5AP (0.33) ALOX5APHSD11B1
SCHEMBL12122765 0.73 TLR8 (0.58) TLR8MAPTHSD11B1BCL2L1MCL1
SCHEMBL10112886 0.72 TLR8 (0.49) TLR8MAPTHSD11B1EZH2BCL2L1
SCHEMBL10112950 0.72 TLR8 (0.49) TLR8MAPTHSD11B1EZH2BCL2L1
SCHEMBL12780756 0.72 TLR8 (0.67) TLR8MAPTHSD11B1EZH2BCL2L1
SCHEMBL12433514 0.72 MAPT (0.50) TLR8MAPTHSD11B1EZH2BCL2L1
SCHEMBL10112879 0.70 ESR1 (0.45) TLR8MAPTHSD11B1EZH2BCL2L1
SCHEMBL22169507 0.70 HSD11B1 (0.57) TLR8MAPTHSD11B1BCL2L1MCL1

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
US-20120052412-A1 POLYARYLENE BLOCK COPOLYMER HAVING SULFONIC ACID GROUP AND USE THEREOF HONDA MOTOR CO., LTD. (JP) 2012-03-01 US disclosed