SCHEMBL6666484

SCHEMBL6666484

O=S(=O)(O)c1cc2nc3ccccc3nc2c2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.57
MAX P61244 1/20 0.57
RCE1 Q9Y256 1/20 0.50
MPL P40238 8/20 0.45
CTRC Q99895 2/20 0.41
ALDH1A1 P00352 4/20 0.41
CYP2C19 P33261 2/20 0.41
TSHR P16473 1/20 0.41
SUMO2 P61956 1/20 0.39
SUMO1 P63165 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP2 Q9HC62 1/20 0.39
SENP1 Q9P0U3 1/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP1A2 P05177 2/20 0.39
HIF1A Q16665 2/20 0.39
TTR P02766 1/20 0.39
NQO2 P16083 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
SCHEMBL13410554 0.87 MYC (0.50) MYCMAXRCE1MPLALDH1A1
Water SCHEMBL11321734 0.76 TTR (0.46) MYCMAXRCE1MPLALDH1A1
SCHEMBL390404 0.76 MPL (0.53) RCE1MPLCTRCALDH1A1CYP2C19
SCHEMBL28338713 0.75 ALDH1A1 (0.55) MYCMAXALDH1A1CYP2C19RAB9A
SCHEMBL11775426 0.74 MPL (0.51) RCE1MPLCTRCALDH1A1CYP2C19
SCHEMBL24474073 0.74 MYC (0.44) MYCMAXMPLCTRCALDH1A1
SCHEMBL9550436 0.74 MPL (0.55) MPLCTRCALDH1A1CYP2C19TSHR
SCHEMBL28457455 0.74 ALDH1A1 (0.53) MYCMAXALDH1A1CYP2C19RAB9A
SCHEMBL8775745 0.74 RCE1 (0.47) RCE1MPLCTRCALDH1A1CYP2C19
SCHEMBL28338912 0.74 ALDH1A1 (0.53) MYCMAXALDH1A1CYP2C19RAB9A

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
WO-2016037221-A1 LIGHT ACTIVATED ELECTROCHEMISTRY NEWSOUTH INNOVATIONS PTY LIMITED (AU) 2016-03-17 WO disclosed
WO-2004023128-A1 DETECTION OF TARGET NUCLEIC ACID MOLECULES BY ALTERATION OF REACTION OF A REDOX SPECIES FOLLOWING HYBRIDIZATION WITH IMMOBLIZED CAPTURE NUCLEIC ACID MOLECULES UNISEARCH LIMITED (AU) 2004-03-18 WO disclosed