SCHEMBL8968686

SCHEMBL8968686

O=C(O)c1ccc(OCCO)c(O)c1O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SELL P14151 1/20 0.47
SELP P16109 1/20 0.47
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 2/20 0.42
IDO1 P14902 1/20 0.42
KMT2A Q03164 1/20 0.42
PTK2B Q14289 1/20 0.42
HNF4A P41235 1/20 0.41

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
SCHEMBL7070645 0.82 IDO1 (0.55) MAPTTDP1ALDH1A1IDO1KMT2A
SCHEMBL574716 0.82 MAPT (0.63) MAPTTDP1ALDH1A1IDO1KMT2A
SCHEMBL14760916 0.80 MAPT (0.51) SELLSELPMAPTTDP1ALDH1A1
Ethylene Glycol SCHEMBL28894280 0.78 SELL (0.65) SELLSELPMAPTTDP1ALDH1A1
SCHEMBL31196826 0.77 ESR1 (0.51) MAPTTDP1ALDH1A1KMT2APTK2B
SCHEMBL6933452 0.77 ESR1 (0.51) MAPTTDP1ALDH1A1KMT2APTK2B
SCHEMBL10928397 0.76 L3MBTL1 (0.60) MAPTTDP1ALDH1A1KMT2A
SCHEMBL6373411 0.76 ALDH1A1 (0.40) MAPTTDP1ALDH1A1IDO1KMT2A
SCHEMBL7104940 0.75 ALDH1A1 (0.45) SELLSELPMAPTTDP1ALDH1A1
SCHEMBL27289587 0.75 KMT2A (0.39) ALDH1A1KMT2APTK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0509149-B1 Thermal dye sublimation transfer receiving element AGFA GEVAERT NV (BE) 1996-03-13 EP disclosed
US-5284815-A Image-receiving layer containing an isocyanate-based polymer having a crosslinked and cured surface; dyeability; releasability from the dye donor element AGFA-GEVAERT, N.V. (BE) 1994-02-08 US disclosed
EP-0509149-A1 Thermal dye sublimation transfer receiving element AGFA-GEVAERT N.V. (BE) 1992-10-21 EP disclosed