SCHEMBL7027995

SCHEMBL7027995

C=CC(=O)OC(CO)(OC(=O)C=C)n1c(=O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HIF1A Q16665 1/20 0.35
TSHR P16473 1/20 0.31

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
SCHEMBL7640851 0.85 ALDH1A1 (0.40) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL27755602 0.78
SCHEMBL9696445 0.77 TSHR (0.32) TSHR
SCHEMBL152168 0.74 TSHR (0.41) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL2488022 0.73
SCHEMBL7028000 0.72
SCHEMBL13834296 0.71 TSHR (0.30) TSHR
SCHEMBL5178137 0.70
SCHEMBL6906483 0.69 TSHR (0.39) ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2
SCHEMBL290140 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0879828-B1 PHOTOSENSITIVE RESIN COMPOSITION AND ARTICLES NIPPON KAYAKU KK (JP) 2003-03-05 EP disclosed
EP-0879828-A1 PHOTOSENSITIVE RESIN COMPOSITION AND ARTICLES NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1998-11-25 EP disclosed