SCHEMBL7128617

SCHEMBL7128617

Nc1cc2ccccc2c(O)c1N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN22 Q9Y2R2 1/20 0.45
TRPM4 Q8TD43 1/20 0.45
PKM P14618 1/20 0.44
NQO2 P16083 1/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 3/20 0.43
HSD17B10 Q99714 3/20 0.43
TSHR P16473 2/20 0.43
CYP3A4 P08684 1/20 0.43
KEAP1 Q14145 1/20 0.43
CASP6 P55212 1/20 0.43
KDM4E B2RXH2 3/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
MPI P34949 1/20 0.42
NQO1 P15559 1/20 0.42
HPRT1 P00492 1/20 0.41
IDO1 P14902 2/20 0.40
RAB9A P51151 2/20 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
SCHEMBL10535788 0.84 CASP6 (0.48) PTPN22TRPM4PKMNQO2ALDH1A1
SCHEMBL17448333 0.83 TRPM4 (0.56) PTPN22TRPM4PKMNQO2ALDH1A1
SCHEMBL11788064 0.80 KMT2A (0.55) PTPN22TRPM4NQO2ALDH1A1HPGD
SCHEMBL29463710 0.79 ALDH1A1 (0.48) TRPM4NQO2ALDH1A1HPGDHSD17B10
SCHEMBL677653 0.79 ALDH1A1 (0.48) TRPM4NQO2ALDH1A1HPGDHSD17B10
SCHEMBL31281983 0.79 ALDH1A1 (0.48) TRPM4NQO2ALDH1A1HPGDHSD17B10
SCHEMBL8845560 0.79 PTPN22 (0.42) PTPN22TRPM4PKMNQO2ALDH1A1
SCHEMBL8845566 0.79 PTPN22 (0.42) PTPN22TRPM4PKMNQO2ALDH1A1
SCHEMBL995536 0.79 PKM (0.50) PTPN22TRPM4PKMNQO2ALDH1A1
SCHEMBL12124161 0.77 ALDH1A1 (0.46) TRPM4NQO2ALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4372811-A INHIBITION OF DEGRADATION OF CARBOHYDRATES MO OCH DOMSJO AKTIEBOLAG (SE) 1983-02-08 US claimed
EP-3512905-A1 METHOD FOR PRODUCING A POLYBENZAZOL POLYMER (P) BASF SE (DE) 2019-07-24 EP disclosed
US-6664297-B1 Impeding formation of amyloid fibers or dissolving existing fibers in mammals UNIVERSIDADE FEDERAL DO RIO DE JANEIRO (BR) 2003-12-16 US disclosed
JP-2001143870-A PHENOXAZONE COMPOUND, DIAMINO NAPHTHOL DERIVATIVE AND ORGANIC THIN FILM EL ELEMENT USING PHENOXAZONE COMPOUND TOPPAN PRINTING CO LTD 2001-05-25 JP disclosed
WO-2001028546-A1 INHIBITION OF AMYLOIDOSES BY USING AROMATIC OR HETEROAROMATIC COMPOUNDS SUBSTITUTED BY ELECTRON-WITHDRAWING GROUPS UNIVERSIDADE FEDERAL DO RIO DE JANEIRO (BR) 2001-04-26 WO disclosed
EP-0621299-B1 Solutions of polyimide-forming substances and their use as coating material BASF LACKE & FARBEN (DE) 1997-07-09 EP disclosed
EP-0596150-B1 Solutions of polyimide precursors BASF LACKE & FARBEN (DE) 1997-02-05 EP disclosed
EP-0596149-B1 Solutions of polyimide precursors BASF LACKE & FARBEN (DE) 1996-10-16 EP disclosed
US-5489644-A COMPRISING AROMATIC DIAMINES AND TETRAESTER OF AROMATIC TETRACARBOXYLIC ACID; PROTECTIVE COATING FOR METALS, SILICON WAFERS, GLASS BASF LACKE + FARBEN (DE) 1996-02-06 US disclosed
EP-0621299-A1 Solutions of polyimide-forming substances and their use as coating material BASF Lacke + Farben AG (DE) 1994-10-26 EP disclosed
US-5332799-A Aromatic diamines, diesters of aromatic tetracarboxylic acids, circuit coatings BASF LACKE+FARBEN AKTIENGESELLSCHAFT (DE) 1994-07-26 US disclosed
EP-0596150-A1 Solutions of polyimide precursors BASF Lacke + Farben Aktiengesellschaft (DE) 1994-05-11 EP disclosed
EP-0596149-A1 Solutions of polyimide precursors BASF Lacke + Farben Aktiengesellschaft (DE) 1994-05-11 EP disclosed
US-5264545-A Aromatic or partly aromatic diamine with tetracarboxylic acid BASF LACKE+FARBEN AKTIENGESELLSCHAFT (DE) 1993-11-23 US disclosed
US-4372811-A INHIBITION OF DEGRADATION OF CARBOHYDRATES MO OCH DOMSJO AKTIEBOLAG (SE) 1983-02-08 US disclosed