SCHEMBL7938501

SCHEMBL7938501

C=CC(=O)OCCOCCC(CCOCCOC(=O)C=C)(COCCO)n1c(=O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.43
ALDH1A1 P00352 4/20 0.43
TP53 P04637 3/20 0.43
HIF1A Q16665 3/20 0.43
HSD17B10 Q99714 1/20 0.43
THRB P10828 2/20 0.41
CYP3A4 P08684 2/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL7925926 0.83 THRB (0.39) TSHRTHRB
SCHEMBL152168 0.80 TSHR (0.41) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL6905749 0.79 THRB (0.36) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL1537378 0.72 TSHR (0.83) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL1537467 0.72 TSHR (0.83) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL1537388 0.72 TSHR (0.83) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL139735 0.72 TSHR (0.83) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL8852469 0.72 TSHR (0.83) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL10533428 0.72 TSHR (0.83) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL259313 0.72 TSHR (0.83) 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
US-6306502-B1 COMPOSITION COMPRISING ULTRAVIOLET-CURABLE SILICONE, MONOMER MIXTURE COMPRISING TRIS((METH)ACRYLOYLOXYALKYL)ISOCYANURATE AND URETHANE POLY(METH)ACRYLATE HAVING ALICYCLIC SKELETON, PHOTOPOLYMERIZATION INITIATOR MITSUBISHI RAYON CO., LTD. (JP) 2001-10-23 US disclosed
EP-0869154-A1 COATING COMPOSITION FORMING WEAR-RESISTANT COAT AND ARTICLE COVERED WITH THE COAT MITSUBISHI RAYON CO., LTD. (JP) 1998-10-07 EP disclosed