SCHEMBL7929919

SCHEMBL7929919

CCOC(=O)c1cc(CC)c(N)c(CC)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.58
CA2 P00918 4/20 0.58
CA12 O43570 3/20 0.58
CA7 P43166 3/20 0.58
CA9 Q16790 3/20 0.58
CA14 Q9ULX7 3/20 0.58
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
MAOA P21397 1/20 0.56
NPC1 O15118 1/20 0.51
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
GAA P10253 2/20 0.47
MAPK1 P28482 1/20 0.47
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL7930946 0.87 CA12 (0.53) CA1CA2CA12CA7CA9
SCHEMBL7932932 0.84 ALDH1A1 (0.55) CA1CA2CA12CA7CA9
SCHEMBL7929808 0.84 CA12 (0.50) CA1CA2CA12CA7CA9
SCHEMBL1101657 0.82 CA12 (0.60) CA1CA2CA12CA7CA9
SCHEMBL6901103 0.82 CA12 (0.50) CA1CA2CA12CA7CA9
SCHEMBL9741791 0.82 CA12 (0.66) CA1CA2CA12CA7CA9
SCHEMBL1664013 0.81 CA12 (0.75) CA1CA2CA12CA7CA9
SCHEMBL7929916 0.81 CA12 (0.58) CA1CA2CA12CA7CA9
SCHEMBL1278720 0.80 NPC1 (0.68) CA1CA2CA12CA7CA9
SCHEMBL2810136 0.80 NPC1 (0.68) CA1CA2CA12CA7CA9

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 5 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
EP-0661350-A1 Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1995-07-05 EP disclosed