SCHEMBL7929923

SCHEMBL7929923

COc1cc([N+](=O)[O-])cc(OC)c1[NH]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.56
ERN1 O75460 1/20 0.53
TDP1 Q9NUW8 2/20 0.50
PKM P14618 2/20 0.46
KMT2A Q03164 5/20 0.45
LMNA P02545 4/20 0.45
MEN1 O00255 3/20 0.45
TSHR P16473 1/20 0.45
PTGS2 P35354 2/20 0.45
CYP19A1 P11511 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 2/20 0.42
ALOX5 P09917 1/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX15 P16050 1/20 0.42
PRKDC P78527 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL6313062 0.81 PTGS2 (0.62) HTTERN1TDP1PKMLMNA
SCHEMBL4946627 0.79 ERN1 (0.72) HTTERN1TDP1PKMKMT2A
SCHEMBL7929928 0.79 HTT (0.67) HTTERN1TDP1PKMKMT2A
SCHEMBL10981831 0.79 HTT (0.56) HTTERN1TDP1PKMKMT2A
Potassium Ion SCHEMBL6313612 0.79 ERN1 (0.57) HTTERN1TDP1PKMKMT2A
SCHEMBL7929934 0.79 HTT (0.42) HTTERN1TDP1KMT2ALMNA
SCHEMBL7933244 0.79 MAPT (0.48) HTTKMT2ALMNAMEN1TSHR
SCHEMBL7930908 0.79 CYP19A1 (0.50) HTTERN1TDP1KMT2ALMNA
SCHEMBL7929947 0.79 HTT (0.66) HTTTDP1PKMKMT2ALMNA
SCHEMBL11577328 0.77 ERN1 (0.64) HTTERN1TDP1PKMKMT2A

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 6 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-5968688-A RESINS AND DYES FOR COLOR FILTERS NIPPON SHOKUBAI CO., LTD. (JP) 1999-10-19 US disclosed
US-5817843-A Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1998-10-06 US disclosed
EP-0833203-A1 Color filter grade photosensitive resin coloring composition, and color filter using the same NIPPON SHOKUBAI CO., LTD. (JP) 1998-04-01 EP 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