SCHEMBL6003919

SCHEMBL6003919

O=C(O)c1nc(C(=O)O)c(-c2ccccc2-c2oc(C(=O)O)nc2C(=O)O)o1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.54
ALDH1A1 P00352 3/20 0.44
MAPT P10636 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
PTPN1 P18031 2/20 0.39
RXRA P19793 2/20 0.36
RXRB P28702 2/20 0.36
RXRG P48443 1/20 0.36
PIN1 Q13526 2/20 0.35
CYP1A2 P05177 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
CYP2C19 P33261 1/20 0.35
RAB9A P51151 2/20 0.35
KMT2A Q03164 2/20 0.35
HTT P42858 2/20 0.35
APAF1 O14727 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL1167117 0.73 RXRA (0.46) NR4A2ALDH1A1MAPTSMN1; SMN2RXRA
SCHEMBL23833753 0.71 NR4A2 (0.59) NR4A2ALDH1A1PTPN1RXRARXRB
SCHEMBL5098755 0.70 NR4A2 (1.00) NR4A2ALDH1A1RXRARXRBRXRG
SCHEMBL627224 0.70 NR4A2 (0.46) NR4A2ALDH1A1MAPTSMN1; SMN2RXRA
SCHEMBL8823122 0.69 ALDH1A1 (0.50) NR4A2ALDH1A1SMN1; SMN2RXRARXRB
SCHEMBL8823073 0.69 NR4A2 (0.51) NR4A2ALDH1A1SMN1; SMN2RXRARXRB
SCHEMBL1166806 0.68 KDM4E (0.51) ALDH1A1RXRACYP2C19KMT2AMEN1
SCHEMBL4487202 0.67 IKBKB (0.56) NR4A2ALDH1A1MAPTSMN1; SMN2PTPN1
SCHEMBL2960024 0.66 NR4A2 (0.49) NR4A2ALDH1A1MAPTSMN1; SMN2PTPN1
SCHEMBL1167223 0.66 MAPK13 (0.50) NR4A2ALDH1A1MAPTSMN1; SMN2PTPN1

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
US-20060159413-A1 POLYIMIDE OPTICAL MATERIALS, POLYIMIDE PRECURSOR SOLUTIONS AND OPTICAL WAVEGUIDE ELEMENTS KABUSHIKI KAISHA TOSHIBA (JP) 2006-07-20 US claimed
US-7092608-B2 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2006-08-15 US disclosed
US-7082244-B2 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2006-07-25 US disclosed
US-20060159413-A1 POLYIMIDE OPTICAL MATERIALS, POLYIMIDE PRECURSOR SOLUTIONS AND OPTICAL WAVEGUIDE ELEMENTS KABUSHIKI KAISHA TOSHIBA (JP) 2006-07-20 US disclosed
US-20040197064-A1 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2004-10-07 US disclosed