SCHEMBL28036451

SCHEMBL28036451

CCCCCCCCCCCCCCCCCCn1c(CCl)nc2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 3/20 0.65
TP53 P04637 4/20 0.60
POLB P06746 1/20 0.60
LMNA P02545 1/20 0.59
RECQL P46063 1/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
SMN1; SMN2 Q16637 3/20 0.56
MAPT P10636 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
USP2 O75604 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
ALDH1A1 P00352 1/20 0.56
HTT P42858 1/20 0.56

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
SCHEMBL30184968 1.00 TLR8 (0.65) TLR8TP53POLBLMNARECQL
SCHEMBL28036974 1.00 TLR8 (0.65) TLR8TP53POLBLMNARECQL
SCHEMBL31066866 0.88 TLR8 (0.68) TLR8TP53POLBLMNARECQL
SCHEMBL31066873 0.88 TLR8 (0.68) TLR8TP53POLBLMNARECQL
SCHEMBL3059715 0.88 MEN1 (0.64) TP53POLBLMNARECQLMEN1
SCHEMBL29968482 0.87 LMNA (0.67) TLR8TP53POLBLMNARECQL
SCHEMBL29968953 0.87 LMNA (0.67) TLR8TP53POLBLMNARECQL
SCHEMBL28878994 0.87 LMNA (0.67) TLR8TP53POLBLMNARECQL
SCHEMBL28879019 0.87 LMNA (0.67) TLR8TP53POLBLMNARECQL
SCHEMBL28860662 0.87 LMNA (0.67) TLR8TP53POLBLMNARECQL

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
CN-104974138-A Quinolone benzimidazole compound as well as preparation method and application thereof UNIV SOUTHWEST 2015-10-14 CN disclosed