SCHEMBL7107869

SCHEMBL7107869

CCCCOC(O)C(O)CC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
ALDH1A1 P00352 2/20 0.34
DNM1 Q05193 1/20 0.34
CYP3A4 P08684 3/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
SPHK1 Q9NYA1 2/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
PDE4D Q08499 1/20 0.32
USP2 O75604 1/20 0.32
ATM Q13315 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
HTT P42858 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
SCHEMBL10696347 0.91 DNM1 (0.45) DNM1SPHK1USP2HTT
SCHEMBL14246013 0.85 HSD17B10 (0.37) TSHRLMNAUSP2
SCHEMBL14975586 0.85 TSHR (0.42) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL11417020 0.84 SPHK1 (0.35) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL4248982 0.84 USP2 (0.39) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL15967789 0.81 TSHR (0.36) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL9117707 0.79 TSHR (0.34) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL13108354 0.79 TSHR (0.34) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL29023673 0.79 LMNA (0.38) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL1835984 0.78 TSHR (0.42) TSHRADRB2ADRB1ADRB3ALDH1A1

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-6551759-B2 Multilayer; flexible support, photopolymerizable layer, image recording layer and covering AGFA-GEVAERT (BE) 2003-04-22 US disclosed
EP-1170121-B1 Direct-to-plate flexographic printing plate precursor AGFA GEVAERT (BE) 2002-06-26 EP disclosed
EP-1170121-A1 Direct-to-plate flexographic printing plate precursor Agfa-Gevaert naamloze vennootschap (BE) 2002-01-09 EP disclosed