SCHEMBL637852

SCHEMBL637852

O=C(O)/C=C/C(=O)OCCOCCOCCOC(=O)/C=C/C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 12/20 0.65
TSHR P16473 4/20 0.54
TP53 P04637 3/20 0.54
ALDH1A1 P00352 2/20 0.54
HIF1A Q16665 2/20 0.54
HSD17B10 Q99714 1/20 0.54
ATM Q13315 1/20 0.46
EGLN1 Q9GZT9 1/20 0.43
EGLN3 Q9H6Z9 1/20 0.43
AKR1B10 O60218 1/20 0.38
AKR1B1 P15121 1/20 0.38
THRB P10828 1/20 0.36

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
SCHEMBL24040550 1.00 HCAR2 (0.65) HCAR2TSHRTP53ALDH1A1HIF1A
SCHEMBL19029663 1.00 HCAR2 (0.65) HCAR2TSHRTP53ALDH1A1HIF1A
SCHEMBL19029632 1.00 HCAR2 (0.65) HCAR2TSHRTP53ALDH1A1HIF1A
SCHEMBL27407116 1.00 HCAR2 (0.65) HCAR2TSHRTP53ALDH1A1HIF1A
SCHEMBL1246093 1.00 HCAR2 (0.65) HCAR2TSHRTP53ALDH1A1HIF1A
SCHEMBL11045900 0.93 HCAR2 (0.74) HCAR2TSHRTP53ALDH1A1HIF1A
SCHEMBL1246524 0.93 HCAR2 (0.74) HCAR2TSHRTP53ALDH1A1HIF1A
SCHEMBL10780616 0.93 HCAR2 (0.74) HCAR2TSHRTP53ALDH1A1HIF1A
SCHEMBL8648496 0.92 HCAR2 (0.57) HCAR2TSHRTP53ALDH1A1HIF1A
SCHEMBL17187308 0.92 HCAR2 (0.57) HCAR2TSHRTP53ALDH1A1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964696-B2 Chain extenders POLYNOVO BIOMATERIALS PTY LIMITED (AU) 2011-06-21 US claimed
EP-2644578-A1 Copolymer for dispersant for cement, dispersant for cement, and cement composition Technische Universität München (DE) 2013-10-02 EP disclosed
EP-1345985-B9 COUPLING OF REINFORCING FIBRES TO RESINS IN CURABLE COMPOSITES LICOTEC PTY LTD (AU) 2012-02-22 EP disclosed
US-7964696-B2 Chain extenders POLYNOVO BIOMATERIALS PTY LIMITED (AU) 2011-06-21 US disclosed
EP-1345985-B1 COUPLING OF REINFORCING FIBRES TO RESINS IN CURABLE COMPOSITES LICOTEC PTY LTD (AU) 2011-05-18 EP disclosed