SCHEMBL21373880

SCHEMBL21373880

C=CC(=O)OCC(COCC1CO1)(COCC1CO1)COCC1CO1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.50
TP53 P04637 4/20 0.50
HIF1A Q16665 3/20 0.50
CYP3A4 P08684 3/20 0.50
MAPK1 P28482 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
TSHR P16473 8/20 0.43
THRB P10828 1/20 0.43
HSD17B10 Q99714 1/20 0.38
MGLL Q99685 1/20 0.33
HPGD P15428 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL6141641 1.00 ALDH1A1 (0.50) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL10417515 0.88 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL21647280 0.87 THRB (0.54) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL24899844 0.85 THRB (0.37) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL24899647 0.85 THRB (0.37) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL28210908 0.82 ALDH1A1 (0.50) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL673210 0.80 ALDH1A1 (0.48) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL15082542 0.79
SCHEMBL29850839 0.79 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL17692 0.79

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
US-11118047-B2 Composition for a glass fiber-reinforced polyolefin resin material, glass fiber-reinforced polyolefin resin material and its production method, and composite FURUKAWA ELECTRIC CO., LTD. (JP) 2021-09-14 US disclosed
US-20190292360-A1 COMPOSITION FOR A GLASS FIBER-REINFORCED POLYOLEFIN RESIN MATERIAL, GLASS FIBER-REINFORCED POLYOLEFIN RESIN MATERIAL AND ITS PRODUCTION METHOD, AND COMPOSITE FURUKAWA ELECTRIC CO., LTD. (JP) 2019-09-26 US disclosed
EP-3543290-A1 COMPOSITION FOR GLASS FIBER-REINFORCED POLYOLEFIN RESIN MATERIALS, GLASS FIBER-REINFORCED POLYOLEFIN RESIN MATERIAL, METHOD FOR PRODUCING SAME, AND COMPOSITE BODY Furukawa Electric Co., Ltd. (JP) 2019-09-25 EP disclosed