SCHEMBL9077679

SCHEMBL9077679

COP(=O)(O)OC(=O)/C=C/C(=O)OP(=O)(O)OC

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43

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
SCHEMBL27495477 0.81 TSHR (0.34)
SCHEMBL27838663 0.79 TSHR (0.33)
SCHEMBL9077164 0.77 HCAR2 (0.46) HCAR2KEAP1NFE2L2
SCHEMBL28878915 0.77 HCAR2 (0.46) HCAR2KEAP1NFE2L2
SCHEMBL28211888 0.74 HCAR2 (0.41) HCAR2KEAP1NFE2L2
SCHEMBL4362470 0.74
SCHEMBL3653725 0.74
SCHEMBL28270632 0.73 CA4 (0.48) HCAR2KEAP1NFE2L2
SCHEMBL7701026 0.73 CA4 (0.48) HCAR2KEAP1NFE2L2
SCHEMBL6575772 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0519953-B1 ACYL PHOSPHATE ESTERS AND MODIFICATION OF PROTEINS THEREWITH UNIV TORONTO (CA) 1996-02-07 EP disclosed
US-5334707-A Crosslinking UNIVERSITY OF TORONTO INNOVATIONS FOUNDATION, THE (CA) 1994-08-02 US disclosed
EP-0587610-A1 SPECIFICALLY BETA-BETA CROSS-LINKED HEMOGLOBINS AND METHOD OF PREPARATION THE UNIVERSITY OF TORONTO INNOVATIONS FOUNDATION (CA) 1994-03-23 EP disclosed
US-5250665-A Artificial blood THE UNIVERSITY OF TORONTO INNOVATIONS FOUNDATION (CA) 1993-10-05 US disclosed
EP-0519953-A1 ACYL PHOSPHATE ESTERS AND MODIFICATION OF PROTEINS THEREWITH. UNIV TORONTO (CA) 1992-12-30 EP disclosed
WO-1992021702-A1 SPECIFICALLY BETA-BETA CROSS-LINKED HEMOGLOBINS AND METHOD OF PREPARATION THE UNIVERSITY OF TORONTO INNOVATIONS FOUNDATION (CA) 1992-12-10 WO disclosed
WO-1991013891-A1 ACYL PHOSPHATE ESTERS AND MODIFICATION OF PROTEINS THEREWITH THE UNIVERSITY OF TORONTO INNOVATIONS FOUNDATION (CA) 1991-09-19 WO disclosed