SCHEMBL9066700

SCHEMBL9066700

O=C(/C=C/C(=O)OCC(CO)(CO)CO)OCC(CO)(CO)CO

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.61
HIF1A Q16665 2/20 0.61
ALDH1A1 P00352 1/20 0.61
TP53 P04637 1/20 0.61
CYP3A4 P08684 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
HCAR2 Q8TDS4 7/20 0.38
ATM Q13315 1/20 0.38
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
MAPT P10636 1/20 0.31
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL6668000 1.00 MAPK1 (0.61) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL11111824 0.91 TP53 (0.53) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL11807025 0.87 ALDH1A1 (0.53) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL5175932 0.87 ALDH1A1 (0.53) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL11805233 0.87 ALDH1A1 (0.53) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL11799712 0.83 ALDH1A1 (0.50) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL29634762 0.82 ALDH1A1 (0.53) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL9329189 0.82 ALDH1A1 (0.53) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL123908 0.81 ALDH1A1 (0.91) MAPK1HIF1AALDH1A1TP53CYP3A4
SCHEMBL16248483 0.80 HCAR2 (0.55) MAPK1HIF1AALDH1A1TP53CYP3A4

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-0612773-B1 Thermoplastic resin composition and process for preparing modified polyolefin type resin MITSUBISHI CHEM CORP (JP) 1996-12-27 EP disclosed
US-5424359-A Aromatic vinyl polymer having alpha, beta-unsaturated carboxylate having a hydroxyl group grafted onto it, and saturated polyester MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1995-06-13 US disclosed
EP-0612773-A1 Thermoplastic resin composition and process for preparing modified polyolefin type resin MITSUBISHI CHEMICAL CORPORATION (JP) 1994-08-31 EP disclosed