SCHEMBL2907995

SCHEMBL2907995

CCOC(=O)C1=C(C)N(O)C(C)=C(C(=O)OCC)C1(O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CACNA1D Q01668 4/20 0.43
CACNA1C Q13936 3/20 0.43
CACNA1F O60840 2/20 0.43
CACNA1S Q13698 2/20 0.43
KDM4E B2RXH2 2/20 0.40
MAPT P10636 4/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.39
NFKB1 P19838 1/20 0.39
MAPK1 P28482 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
TDP2 O95551 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KMT2A Q03164 2/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39

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
SCHEMBL8896632 0.84 TSHR (0.42) ALDH1A1GAASMN1; SMN2KDM4EMAPT
SCHEMBL2944564 0.84 HSD17B10 (0.39) ALDH1A1SMN1; SMN2CACNA1DCACNA1CCACNA1F
SCHEMBL5445916 0.70 CACNA1D (0.42) ALDH1A1GAASMN1; SMN2CACNA1DCACNA1C
SCHEMBL1523174 0.70 ALDH1A1 (0.67) ALDH1A1GAASMN1; SMN2MAPTRAB9A
SCHEMBL7377281 0.70 CACNA1D (0.38) ALDH1A1GAASMN1; SMN2CACNA1DCACNA1C
SCHEMBL8664750 0.68 ALDH1A1 (0.53) ALDH1A1GAASMN1; SMN2CACNA1DKDM4E
Ethyl Acetate SCHEMBL27861469 0.67 RAB9A (0.52) ALDH1A1GAASMN1; SMN2KDM4ERAB9A
SCHEMBL9645112 0.66 ALDH1A1 (0.57) ALDH1A1GAASMN1; SMN2KDM4EMAPT
SCHEMBL13982721 0.66 ALDH1A1 (0.50) ALDH1A1GAASMN1; SMN2CACNA1CMAPT
SCHEMBL5764011 0.66 TDP1 (0.64) ALDH1A1GAASMN1; SMN2CACNA1CMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1331517-B1 POSITIVE PHOTOSENSITIVE RESIN COMPOSITION, PROCESS FOR ITS PREPARATION, AND SEMICONDUCTOR DEVICES SUMITOMO BAKELITE CO (JP) 2010-08-18 EP disclosed
US-6908717-B2 Positive photosensitive resin composition, process for its preparation, and semiconductor devices SUMITOMO BAKELITE COMPANY LIMITED (JP) 2005-06-21 US disclosed
US-20040023147-A1 Positive photosensitive resin composition, process for its preparation, and semiconductor devices SUMITOMO BAKELITE COMPANY LIMITED (JP) 2004-02-05 US disclosed
EP-1331517-A1 POSITIVE PHOTOSENSITIVE RESIN COMPOSITION, PROCESS FOR ITS PREPARATION, AND SEMICONDUCTOR DEVICES SUMITOMO BAKELITE CO., LTD. (JP) 2003-07-30 EP disclosed