SCHEMBL7049899

SCHEMBL7049899

NC(=O)c1c(O)c(-c2ccccc2)cc2cc(-c3ccccc3)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2B Q13224 1/20 0.49
GRIN2C Q14957 1/20 0.49
IKBKB O14920 2/20 0.43
PTPN1 P18031 1/20 0.43
HSD17B1 P14061 1/20 0.42
HSD17B2 P37059 1/20 0.42
CHUK O15111 1/20 0.41
ESR1 P03372 3/20 0.40
ESR2 Q92731 3/20 0.40
BCAT2 O15382 1/20 0.40
DHODH Q02127 2/20 0.40
CHEK2 O96017 1/20 0.39
MKNK1 Q9BUB5 1/20 0.39
RAB9A P51151 1/20 0.39
ERN1 O75460 2/20 0.39
F9 P00740 1/20 0.38
HNF4A P41235 2/20 0.38
ACMSD Q8TDX5 2/20 0.38

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
SCHEMBL5553181 0.86 MEN1 (0.49) PTPN1BCAT2RAB9AGRM2
SCHEMBL7946080 0.82 PTPRC (0.38) GRIN2DGRIN2AGRIN2BGRIN2CPTPN1
SCHEMBL5014948 0.79 ESR1 (0.55) GRIN2DGRIN2AGRIN2BGRIN2CIKBKB
SCHEMBL7949396 0.78 MCL1 (0.49) ACMSDMCL1
SCHEMBL16772452 0.78 ESR1 (0.53) GRIN2DGRIN2AGRIN2BGRIN2CPTPN1
SCHEMBL27418979 0.76 PLAU (0.49)
SCHEMBL27416862 0.74 PLAU (0.47) RAB9A
SCHEMBL338938 0.73 MEN1 (0.61) PTPN1DHODH
SCHEMBL6938551 0.72 GRIN2D (0.45) GRIN2DGRIN2AGRIN2BGRIN2CPTPN1
SCHEMBL5023242 0.71 PDE4A (0.44) IKBKBHSD17B1HSD17B2MKNK1F9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1163548-C Toning agent 株式会社上野制药应用研究所 2004-08-25 CN disclosed
EP-0882767-B1 BISAZO COMPOUNDS AND PROCESS FOR THE PREPARATION THEREOF UENO SEIYAKU OYO KENKYUJO KK (JP) 2003-04-16 EP disclosed
US-6548703-B1 Toning agent KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 2003-04-15 US disclosed
US-6252104-B1 3,6-DISUBSTITUTED-2-OXYNAPHTHALENE DERIVATIVES; RAW MATERIALS FOR SYNTHESIS OF SUCH MATERIALS AS DYES, PIGMENTS, PHOTOSENSITIVE MATERIALS KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 2001-06-26 US disclosed
CN-1291215-A Toning agent UENO SEIYAKU OYO KENKYUJO KK (JP) 2001-04-11 CN disclosed
EP-1043364-A1 TONING AGENT KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 2000-10-11 EP disclosed
EP-0765858-B1 NAPHTHOL DERIVATIVES AND PROCESS FOR PRODUCING THE SAME UENO SEIYAKU OYO KENKYUJO KK (JP) 1999-12-22 EP disclosed
US-5965715-A Bisazo compounds and process for the preparation thereof KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1999-10-12 US disclosed
EP-0882767-A1 BISAZO COMPOUNDS AND PROCESS FOR THE PREPARATION THEREOF KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1998-12-09 EP disclosed
US-5847233-A Naphthol derivatives and process for producing the same KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1998-12-08 US disclosed
US-5786523-A Naphthol derivatives and process for producing the same KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1998-07-28 US disclosed
EP-0765858-A1 NAPHTHOL DERIVATIVES AND PROCESS FOR PRODUCING THE SAME KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1997-04-02 EP disclosed