SCHEMBL7921285

SCHEMBL7921285

CCCCOc1c(Nc2ccc(O)cc2)c(Nc2ccc(O)cc2)c(F)c2c1C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADAMTS5 Q9UNA0 2/20 0.40
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LTA4H P09960 2/20 0.36
NR5A1 Q13285 1/20 0.36
POLH Q9Y253 1/20 0.35
ESR1 P03372 5/20 0.35
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
CYP2C19 P33261 1/20 0.34
NR1H2 P55055 1/20 0.34

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
SCHEMBL7927279 0.91 ADAMTS5 (0.44) ADAMTS5MEN1NPC1ALDH1A1MAPT
SCHEMBL7930029 0.91 ADAMTS5 (0.43) ADAMTS5MEN1NPC1ALDH1A1GAA
SCHEMBL7930019 0.90 ADAMTS5 (0.46) ADAMTS5NPC1RAB9ANR5A1FAAH
SCHEMBL7927126 0.87 ADAMTS5 (0.43) ADAMTS5MEN1NPC1ALDH1A1GAA
SCHEMBL7933295 0.87 ADAMTS5 (0.39) ADAMTS5FAAHCNR2
SCHEMBL7921275 0.86 ADAMTS5 (0.42) ADAMTS5NPC1RAB9ANR5A1FAAH
SCHEMBL7929940 0.84 ELANE (0.34) ADAMTS5MEN1NPC1ALDH1A1GAA
SCHEMBL7928504 0.84 ADAMTS5 (0.38) ADAMTS5MEN1ALDH1A1MAPTKMT2A
SCHEMBL7927144 0.83 ELANE (0.35) ADAMTS5MEN1NPC1ALDH1A1GAA
SCHEMBL7921187 0.83 MAPT (0.48) MEN1NPC1ALDH1A1MAPTRAB9A

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