SCHEMBL20482174

SCHEMBL20482174

COCCCOc1cc(C=O)ccc1Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.59
FDPS P14324 1/20 0.55
ALDH1A1 P00352 13/20 0.54
MAPT P10636 9/20 0.54
HPGD P15428 8/20 0.54
CYP2C9 P11712 3/20 0.54
CYP1A2 P05177 3/20 0.54
CYP2C19 P33261 2/20 0.54
CYP2D6 P10635 1/20 0.54
L3MBTL1 Q9Y468 3/20 0.48
NPSR1 Q6W5P4 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TDP1 Q9NUW8 3/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
ALOX12 P18054 1/20 0.46
MAPK1 P28482 1/20 0.46
RECQL P46063 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL14036000 0.86 LMNA (0.56) LMNAFDPSALDH1A1MAPTHPGD
SCHEMBL31471656 0.84 LMNA (0.54) LMNAFDPSALDH1A1MAPTHPGD
SCHEMBL25781297 0.83 LMNA (0.54) LMNAFDPSALDH1A1MAPTHPGD
SCHEMBL22160259 0.83 FDPS (0.57) LMNAFDPSALDH1A1MAPTHPGD
SCHEMBL218012 0.83 FDPS (0.71) LMNAFDPSALDH1A1MAPTHPGD
SCHEMBL12525838 0.81 FDPS (0.55) LMNAFDPSALDH1A1MAPTHPGD
SCHEMBL1098158 0.81 ALDH1A1 (0.67) LMNAFDPSALDH1A1MAPTHPGD
SCHEMBL11686330 0.81 LMNA (0.54) LMNAFDPSALDH1A1MAPTHPGD
SCHEMBL30694794 0.81 LMNA (0.54) LMNAFDPSALDH1A1MAPTHPGD
SCHEMBL3569232 0.81 LMNA (0.54) LMNAFDPSALDH1A1MAPTHPGD

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
WO-2018154466-A1 DIHYDROQUINOLIZINONES AS ANTIVIRALS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-08-30 WO disclosed