SCHEMBL7933112

SCHEMBL7933112

COc1ccccc1Nc1c(F)c2c(c(F)c1Nc1ccccc1OC)C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.51
PIM1 P11309 1/20 0.51
MAPK1 P28482 5/20 0.46
MAPT P10636 4/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
KDM4E B2RXH2 2/20 0.46
POLB P06746 2/20 0.46
ALDH1A1 P00352 4/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
MCL1 Q07820 1/20 0.44
ATM Q13315 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
STK10 O94804 1/20 0.42
SLK Q9H2G2 1/20 0.42
NPC1 O15118 1/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL7921212 0.95 EGFR (0.49) EGFRPIM1MAPK1MAPTL3MBTL1
SCHEMBL6652196 0.86 MAPT (0.58) EGFRPIM1MAPK1MAPTL3MBTL1
SCHEMBL8771240 0.84 EGFR (0.55) EGFRPIM1MAPK1MAPTL3MBTL1
SCHEMBL7928349 0.81 EGFR (0.52) EGFRPIM1MAPK1MAPTKDM4E
SCHEMBL6651233 0.81 MAPT (0.56) EGFRPIM1MAPK1MAPTL3MBTL1
SCHEMBL29502805 0.81 MAPT (0.56) EGFRPIM1MAPK1MAPTL3MBTL1
SCHEMBL7933046 0.78 ALDH1A1 (0.39) MAPTKDM4EPOLBALDH1A1SMN1; SMN2
SCHEMBL8771507 0.76 HSD17B10 (0.48) EGFRPIM1MAPK1MAPTL3MBTL1
SCHEMBL7929771 0.76 GAA (0.41) MAPK1MAPTPOLBALDH1A1SMN1; SMN2
SCHEMBL7930649 0.76 MEN1 (0.58) EGFRPIM1MAPK1MAPTPOLB

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