SCHEMBL4451990

SCHEMBL4451990

CCc1cc2c(cc1C=O)OCO2

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.58
HPGD P15428 2/20 0.58
ALDH1A1 P00352 6/20 0.46
TDP1 Q9NUW8 2/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPT P10636 5/20 0.43
HSP90AA1 P07900 2/20 0.42
KMT2A Q03164 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ERN1 O75460 1/20 0.39
PKM P14618 1/20 0.38
IGF1R P08069 1/20 0.38
MITF O75030 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
POLB P06746 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL11438824 0.87 LMNA (0.53) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL9678082 0.84 HPGD (0.44) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL14070022 0.83 LMNA (0.64) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL6436185 0.80 MAPT (0.46) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL3133038 0.78 ALDH1A1 (0.41) LMNAHPGDALDH1A1TDP1KMT2A
SCHEMBL4594814 0.78 LMNA (0.59) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL1128702 0.74 HPGD (0.56) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL13850503 0.74 LMNA (0.51) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL31123847 0.74 HPGD (0.56) LMNAHPGDALDH1A1TDP1HSD17B10
SCHEMBL14611765 0.74 LMNA (0.51) LMNAHPGDALDH1A1TDP1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143426-A1 Synthesis of 1,3,6-trisubstituted-2-carboxyquinol-4-ones as selective ET A antagonists and their use as medicaments STEPHANI RALPH ANTHONY 2009-06-04 US disclosed
US-5475024-A Useful in treating liver disease EISAI CO., LTD. (JP) 1995-12-12 US disclosed
US-5292901-A Benzodioxole derivatives EISAI CO., LTD. (JP) 1994-03-08 US disclosed
EP-0281098-B1 BENZODIOXOLE DERIVATIVES, COMPOSITIONS COMPRISING THE SAME, AND THE USE OF THE SAME FOR THE MANUFACTURE OF MEDICAMENTS Eisai Co., Ltd. (JP) 1992-11-25 EP disclosed
US-5110956-A Liver disorders EISAI CO., LTD. (JP) 1992-05-05 US disclosed
EP-0281098-A1 Benzodioxole derivatives, compositions comprising the same, and the use of the same for the manufacture of medicaments Eisai Co., Ltd. (JP) 1988-09-07 EP disclosed