SCHEMBL1783860

SCHEMBL1783860

C=CC(=O)OCCC1CNC(=O)N1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.41
ALDH1A1 P00352 4/20 0.41
TP53 P04637 3/20 0.41
HIF1A Q16665 3/20 0.41
CYP3A4 P08684 3/20 0.41
HSD17B10 Q99714 1/20 0.41
HPGD P15428 1/20 0.38
THRB P10828 2/20 0.36
MAPK1 P28482 3/20 0.31
PDE4A P27815 2/20 0.31
PDE4D Q08499 2/20 0.31
TNF P01375 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL238951 0.79 TSHR (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL2796353 0.71 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL20668163 0.68 ITGB1 (0.38) CYP3A4MAPK1PDE4APDE4DTNF
SCHEMBL28910795 0.68 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL19078815 0.68 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL11921515 0.68 TSHR (0.54) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL16489120 0.68 TSHR (0.54) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL20647462 0.65
SCHEMBL20640349 0.65
SCHEMBL5731962 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8500903-B2 Plaster-based material including an agent capable of trapping formaldehyde BPB LIMITED (GB) 2013-08-06 US claimed
EP-2327672-A1 Plaster-based material including an agent capable of trapping formaldehyde. BPB Limited (GB) 2011-06-01 EP claimed
WO-2011058172-A1 PLASTER-BASED MATERIAL INCLUDING AN AGENT CAPABLE OF TRAPPING FORMALDEHYDE BPB LIMITED (GB) 2011-05-19 WO claimed
US-20110113961-A1 PLASTER-BASED MATERIAL INCLUDING AN AGENT CAPABLE OF TRAPPING FORMALDEHYDE BPB LIMITED (GB) 2011-05-19 US claimed
EP-3429976-A1 PLASTERBOARD Saint-Gobain Placo (FR) 2019-01-23 EP disclosed
US-9174870-B2 Plaster-based material including an agent capable of trapping formaldehyde BPB LIMITED (GB) 2015-11-03 US disclosed
US-20130276673-A1 PLASTER-BASED MATERIAL INCLUDING AN AGENT CAPABLE OF TRAPPING FORMALDEHYDE BPB LTD (GB) 2013-10-24 US disclosed
US-8500903-B2 Plaster-based material including an agent capable of trapping formaldehyde BPB LIMITED (GB) 2013-08-06 US disclosed
EP-2327672-A1 Plaster-based material including an agent capable of trapping formaldehyde. BPB Limited (GB) 2011-06-01 EP disclosed
WO-2011058172-A1 PLASTER-BASED MATERIAL INCLUDING AN AGENT CAPABLE OF TRAPPING FORMALDEHYDE BPB LIMITED (GB) 2011-05-19 WO disclosed
US-20110113961-A1 PLASTER-BASED MATERIAL INCLUDING AN AGENT CAPABLE OF TRAPPING FORMALDEHYDE BPB LIMITED (GB) 2011-05-19 US disclosed