SCHEMBL8636795

SCHEMBL8636795

C=CC(=O)OCCOC(=O)C=C.C=CC(=O)OCCOCCOC(=O)C=C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 1.00
ALDH1A1 P00352 5/20 1.00
TP53 P04637 3/20 1.00
HIF1A Q16665 3/20 1.00
HSD17B10 Q99714 1/20 1.00
CYP3A4 P08684 2/20 0.65
THRB P10828 5/20 0.62
HPGD P15428 1/20 0.58
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ATM Q13315 1/20 0.34
SERPINE1 P05121 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL17936724 1.00 TSHR (1.00) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL338118 1.00 TSHR (1.00) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL10314657 1.00 TSHR (1.00) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL56001 1.00 TSHR (1.00) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL17851185 1.00 TSHR (1.00) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL25514 1.00 TSHR (1.00) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL12701599 1.00 TSHR (1.00) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL4602612 1.00 TSHR (1.00) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL18134826 1.00 TSHR (1.00) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL4951171 1.00 TSHR (1.00) TSHRALDH1A1TP53HIF1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0852593-A1 ACRYLATED POLYETHER POLYOL AND THE USE THEREOF FOR RADIATION-CURABLE FORMULATIONS BASF Coatings Aktiengesellschaft (DE) 1998-07-15 EP disclosed
WO-1997011982-A1 ACRYLATED POLYETHER POLYOL AND THE USE THEREOF FOR RADIATION-CURABLE FORMULATIONS BASF COATINGS AG (DE) 1997-04-03 WO disclosed