SCHEMBL19721695

SCHEMBL19721695

COCC(CO)OC(=O)/C=C\C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 4/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
PRKCA P17252 5/20 0.40
GFPT1 Q06210 1/20 0.38

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
SCHEMBL15599515 0.92 HCAR2 (0.54) HCAR2KEAP1NFE2L2PRKCAGFPT1
SCHEMBL15599516 0.92 HCAR2 (0.54) HCAR2KEAP1NFE2L2PRKCAGFPT1
SCHEMBL18356245 0.90 HCAR2 (0.56) HCAR2KEAP1NFE2L2PRKCAGFPT1
SCHEMBL17048419 0.89 HCAR2 (0.46) HCAR2KEAP1NFE2L2PRKCA
SCHEMBL17048418 0.89 HCAR2 (0.46) HCAR2KEAP1NFE2L2PRKCA
SCHEMBL17048322 0.89 HCAR2 (0.46) HCAR2KEAP1NFE2L2PRKCA
SCHEMBL19721637 0.87 PRKCA (0.41) HCAR2PRKCA
SCHEMBL21015580 0.80 HCAR2 (0.45) HCAR2KEAP1NFE2L2PRKCAGFPT1
SCHEMBL15824042 0.78 HCAR2 (0.52) HCAR2KEAP1NFE2L2PRKCAGFPT1
SCHEMBL15824044 0.78 HCAR2 (0.52) HCAR2KEAP1NFE2L2PRKCAGFPT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2847809-B1 OLIGOMERIC ORGANIC LIGHT EMITTING DIODE(OLED)MATERIALS CONTAINING MULTIPLE CROSSLINKING FUNCTIONS LOMOX LTD (GB) 2017-12-20 EP disclosed