SCHEMBL6003698

SCHEMBL6003698

O=C(O)c1nc(C(=O)O)c(-c2ccccc2-c2sc(C(=O)O)nc2C(=O)O)s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MAPT P10636 2/20 0.44
KDM4E B2RXH2 2/20 0.40
CYP1A2 P05177 2/20 0.39
PIN1 Q13526 2/20 0.39
MAPK1 P28482 1/20 0.39
CASP1 P29466 1/20 0.39
CYP2C19 P33261 1/20 0.39
HPGD P15428 3/20 0.37
TSHR P16473 1/20 0.37
LMNA P02545 1/20 0.36
NOTUM Q6P988 1/20 0.36
RNASEH1 O60930 1/20 0.36
ERCC1 P07992 1/20 0.36
FEN1 P39748 1/20 0.36
ERCC4 Q92889 1/20 0.36
CYP2C9 P11712 1/20 0.34
HSD17B10 Q99714 1/20 0.34
BCL2L1 Q07817 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
SCHEMBL27312661 0.78 KDM4E (0.50) ALDH1A1MAPTKDM4ECYP1A2PIN1
SCHEMBL3315703 0.74 KDM4E (0.47) ALDH1A1SMN1; SMN2MAPTKDM4ECYP1A2
SCHEMBL3006440 0.71 NPC1 (0.41) ALDH1A1SMN1; SMN2MAPTKDM4EHPGD
SCHEMBL1970757 0.71 HPGD (0.46) ALDH1A1SMN1; SMN2MAPTKDM4EPIN1
SCHEMBL5924855 0.70 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2MAPTKDM4ECYP1A2
SCHEMBL3401795 0.70 KDM4E (0.54) ALDH1A1KDM4EHPGDLMNAHSD17B10
SCHEMBL1969038 0.70 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2MAPTKDM4ECYP1A2
SCHEMBL30775061 0.70 HCRTR1 (0.53) NPC1RAB9A
SCHEMBL1520721 0.70 KDM4E (0.47) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10
SCHEMBL269323 0.70 HCRTR1 (0.53) NPC1RAB9A

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