SCHEMBL7930655

SCHEMBL7930655

CCOCCOc1c(Nc2ccc(OCC)cc2)c(Nc2ccc(OCC)cc2)c(F)c2c1C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
MAPT P10636 5/20 0.36
KDM4E B2RXH2 3/20 0.36
LMNA P02545 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
HTT P42858 2/20 0.36
ALDH1A1 P00352 2/20 0.36
NSD2 O96028 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
SYK P43405 1/20 0.36
TP53 P04637 4/20 0.36
THRB P10828 1/20 0.36
ADAMTS5 Q9UNA0 1/20 0.35
POLB P06746 2/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
RAD52 P43351 1/20 0.35

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
SCHEMBL7928504 0.97 ADAMTS5 (0.38) KMT2AMEN1MAPTKDM4ELMNA
SCHEMBL7927126 0.94 ADAMTS5 (0.43) KMT2AMEN1MAPTL3MBTL1HTT
SCHEMBL7927279 0.92 ADAMTS5 (0.44) KMT2AMEN1MAPTKDM4ELMNA
SCHEMBL7930019 0.84 ADAMTS5 (0.46) ADAMTS5NPC1RAB9A
SCHEMBL7921285 0.83 ADAMTS5 (0.40) KMT2AMEN1MAPTLMNAL3MBTL1
SCHEMBL7921275 0.82 ADAMTS5 (0.42) ADAMTS5NPC1RAB9A
SCHEMBL7930029 0.81 ADAMTS5 (0.43) KMT2AMEN1MAPTL3MBTL1ALDH1A1
SCHEMBL7933295 0.77 ADAMTS5 (0.39) ADAMTS5
SCHEMBL7921187 0.75 MAPT (0.48) KMT2AMEN1MAPTKDM4EHTT
SCHEMBL7929940 0.74 ELANE (0.34) KMT2AMEN1MAPTL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661350-B1 Quinizarin compound, method for production thereof, and use therefor NIPPON CATALYTIC CHEM IND (JP) 2001-08-22 EP disclosed
US-5817843-A Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1998-10-06 US disclosed
US-5608091-A SHEETS FOR HEAT EXCHANGING AND OPTICAL RECORDING MATERIAL NIPPON SHOKUBAI CO., LTD. (JP) 1997-03-04 US disclosed
EP-0661350-A1 Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1995-07-05 EP disclosed