SCHEMBL20189173

SCHEMBL20189173

O=Cc1cc2c(s1)C(=O)c1c(O)cccc1C2=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
MAOA P21397 3/20 0.56
ALDH1A1 P00352 3/20 0.56
TSHR P16473 3/20 0.56
TDP1 Q9NUW8 3/20 0.56
MAPK1 P28482 2/20 0.56
LMNA P02545 2/20 0.56
HPGD P15428 2/20 0.56
ALOX15 P16050 2/20 0.56
MAOB P27338 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
HSD17B10 Q99714 2/20 0.56
HTT P42858 1/20 0.56
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
KDM4E B2RXH2 4/20 0.48
RECQL P46063 4/20 0.48
ELANE P08246 4/20 0.48
CYP3A4 P08684 2/20 0.48
USP2 O75604 2/20 0.48

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
SCHEMBL10037460 0.94 MAOA (0.58) MAPTMAOAALDH1A1TSHRTDP1
SCHEMBL20187629 0.80 MEN1 (0.48) MAPTALDH1A1TDP1LMNASMN1; SMN2
SCHEMBL20187563 0.76 ALDH1A1 (0.56) MAPTMAOAALDH1A1TSHRTDP1
SCHEMBL20187634 0.75 ALDH1A1 (0.54) MAPTMAOAALDH1A1TSHRTDP1
Danthron SCHEMBL30544826 0.74 MAPT (1.00) MAPTMAOAALDH1A1TSHRTDP1
Danthron SCHEMBL83688 0.74 MAPT (1.00) MAPTMAOAALDH1A1TSHRTDP1
Danthron SCHEMBL29356886 0.74 MAPT (1.00) MAPTMAOAALDH1A1TSHRTDP1
1-Hydroxyanthraquinone SCHEMBL1893347 0.73 MAOA (0.83) MAPTMAOAALDH1A1TSHRTDP1
Danthron SCHEMBL30721499 0.72 MAPT (0.95) MAPTMAOAALDH1A1TSHRTDP1
Danthron SCHEMBL20565674 0.72 MAPT (0.95) MAPTMAOAALDH1A1TSHRTDP1

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-2018096401-A1 NEW NAPHTHO[2,3-B]FURAN DERIVATIVES BAN HITOSHI (JP) 2018-05-31 WO claimed