SCHEMBL9575355

SCHEMBL9575355

O=C(O)c1nccc2ccc(O)cc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGFBP3 P17936 1/20 0.43
PLAU P00749 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ASPH Q12797 1/20 0.41
KDM8 Q8N371 1/20 0.41
LMNA P02545 1/20 0.40
ALDH1A1 P00352 3/20 0.39
CYP3A4 P08684 2/20 0.39
TSHR P16473 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
BLM P54132 1/20 0.39
AGER Q15109 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP17A1 P05093 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
TRPV1 Q8NER1 3/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL274802 0.86 IGFBP3 (0.43) IGFBP3PLAUKDM4EASPHKDM8
SCHEMBL28608865 0.82 PLAU (0.60) IGFBP3PLAUKDM4EASPHKDM8
SCHEMBL4726584 0.81 IGFBP3 (0.47) IGFBP3PLAUKDM4EASPHKDM8
SCHEMBL756471 0.81 KDM4E (0.47) IGFBP3PLAUKDM4EASPHKDM8
SCHEMBL13258529 0.81 PLAU (0.41) IGFBP3PLAUKDM4EASPHKDM8
SCHEMBL755956 0.81 KMO (0.42) IGFBP3PLAUKDM4EASPHKDM8
SCHEMBL11374392 0.80 IGFBP3 (0.64) IGFBP3KDM4EASPHKDM8ALDH1A1
SCHEMBL755949 0.77 PLAU (0.57) PLAUKDM4EASPHKDM8LMNA
SCHEMBL15844723 0.77 PLAU (0.46) IGFBP3PLAUKDM4EASPHKDM8
SCHEMBL13153181 0.77 PLAU (0.38) IGFBP3PLAUKDM4EASPHKDM8

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
JP-5310705-A None JP disclosed
JP-H05310705-A NEW ISOQUINOLINECARBOXYLIC ACID DERIVATIVE SNOW BRAND MILK PROD CO LTD 1993-11-22 JP disclosed