SCHEMBL5843386

SCHEMBL5843386

Cc1c(O)cc2ccccc2c1C=O

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 7/20 0.58
TRPM4 Q8TD43 1/20 0.47
GLO1 Q04760 1/20 0.46
PADI4 Q9UM07 1/20 0.44
CYP1A2 P05177 2/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NQO2 P16083 1/20 0.41
CYP2A6 P11509 1/20 0.41
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
HTT P42858 1/20 0.40
MPL P40238 1/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL5841822 0.83 ERN1 (0.63) ERN1TRPM4GLO1PADI4CYP1A2
SCHEMBL29407829 0.81 ERN1 (0.61) ERN1TRPM4GLO1PADI4CYP1A2
SCHEMBL1055398 0.81 CYP1A2 (0.48) ERN1GLO1PADI4CYP1A2MAPT
SCHEMBL125970 0.81 ERN1 (0.61) ERN1TRPM4GLO1PADI4CYP1A2
Methyl Alcohol SCHEMBL27670101 0.79 ERN1 (0.57) ERN1GLO1PADI4CYP1A2MAPT
SCHEMBL5841529 0.79 ERN1 (0.44) ERN1GLO1PADI4CYP1A2MAPT
SCHEMBL4775285 0.79 ERN1 (0.44) ERN1GLO1PADI4CYP1A2MAPT
SCHEMBL13018006 0.79 ERN1 (0.54) ERN1GLO1PADI4CYP1A2MAPT
SCHEMBL5843636 0.78 ERN1 (0.53) ERN1TRPM4GLO1PADI4CYP1A2
SCHEMBL5840936 0.78 ERN1 (0.53) ERN1TRPM4GLO1PADI4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6984716-B2 Phosphorus-containing compound CHANG CHUN PLASTICS CO., LTD. (TW) 2006-01-10 US disclosed
US-20040077825-A1 Phosphorus-containing compound CHANG CHUN PLASTICS CO., LTD. (TW) 2004-04-22 US disclosed