SCHEMBL2401741

SCHEMBL2401741

O=C(O)CC(CC(=O)O)(CC(=O)O)C(CO)(CO)CO

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
HMGCR P04035 1/20 0.41
CHRM1 P11229 1/20 0.41
TBXA2R P21731 1/20 0.41
ADRA1A P35348 1/20 0.41
CYP2D6 P10635 3/20 0.39
CYP2C19 P33261 3/20 0.39
HIF1A Q16665 3/20 0.39
TSHR P16473 1/20 0.39
ACLY P53396 3/20 0.37
CPT2 P23786 2/20 0.37
KDM4E B2RXH2 1/20 0.35
FFAR1 O14842 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TET2 Q6N021 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
LDHA P00338 1/20 0.32
SRR Q9GZT4 1/20 0.32
LMNA P02545 1/20 0.32
ALKBH5 Q6P6C2 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
SCHEMBL540504 0.84 ALDH1A1 (0.35) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL7527191 0.82 LMNA (0.36) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL6558430 0.78 LDHA (0.38) LDHASRR
SCHEMBL12386935 0.71 ALDH1A1 (0.43) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL4807365 0.71 ALDH1A1 (0.43) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL9770202 0.71 ALDH1A1 (0.43) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL434773 0.71 MEN1 (0.39) ALDH1A1TSHRLMNA
SCHEMBL10586751 0.69
SCHEMBL7039700 0.69 ALDH1A1 (0.48) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL6364861 0.69 HMGCR (0.48) ALDH1A1HMGCRCHRM1TBXA2RADRA1A

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2740497-B1 Medical adhesive compound AESCULAP AG (DE) 2017-12-06 EP disclosed
EP-2366721-B1 Medical kit for use during negative pressure wound therapy AESCULAP AG (DE) 2016-08-10 EP disclosed
EP-2223706-B1 Medical adhesive compound AESCULAP AG (DE) 2014-09-03 EP disclosed
EP-2740497-A1 Medical adhesive compound Aesculap AG (DE) 2014-06-11 EP disclosed
EP-2366721-A1 Medical kit for use during negative pressure wound therapy AESCULAP AG (DE) 2011-09-21 EP disclosed
EP-2223706-A2 Medical adhesive compound Aesculap AG (DE) 2010-09-01 EP disclosed
EP-2142223-A2 KIT FOR APPLYING A POLYMERISABLE ADHESIVE COMPOSITION TO TISSUES Henkel AG & Co. KGaA (DE) 2010-01-13 EP disclosed
EP-2137275-A1 RAPIDLY CURING CYANACRYLATES AS ADHESIVES Henkel AG & Co. KGaA (DE) 2009-12-30 EP disclosed
EP-2041232-A1 ADHESIVE MIXTURES HAVING POLYACRYLNITRILE Henkel AG & Co. KGaA (DE) 2009-04-01 EP disclosed
WO-2008128903-A2 KIT FOR APPLYING A POLYMERISABLE ADHESIVE COMPOSITION TO TISSUES HENKEL AG & CO. KGAA (DE) 2008-10-30 WO disclosed
EP-1702016-B1 GAP-BRIDGING CYANOACRYLATE ADHESIVE HENKEL AG & CO KGAA (DE) 2008-07-02 EP disclosed
WO-2008006694-A1 ADHESIVE MIXTURES HAVING POLYACRYLNITRILE HENKEL AG & CO. KGAA (DE) 2008-01-17 WO disclosed
EP-1702016-A1 GAP-BRIDGING CYANOACRYLATE ADHESIVE Henkel Kommanditgesellschaft auf Aktien (DE) 2006-09-20 EP disclosed
EP-1034230-B1 CYANACRYLATE ADHESIVE WITH ESTER AND POLYMER ADDITIVES HENKEL KGAA (DE) 2005-10-12 EP disclosed
WO-2005066296-A1 GAP-BRIDGING CYANOACRYLATE ADHESIVE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-07-21 WO disclosed
EP-0904328-B1 CYANACRYLATE ADHESIVE HENKEL KGAA (DE) 2002-07-31 EP disclosed
EP-1034230-A1 CYANACRYLATE ADHESIVE WITH ESTER AND POLYMER ADDITIVES Henkel Kommanditgesellschaft auf Aktien (DE) 2000-09-13 EP disclosed
WO-1999028399-A1 CYANACRYLATE ADHESIVE WITH ESTER AND POLYMER ADDITIVES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1999-06-10 WO disclosed
EP-0904328-A1 CYANACRYLATE ADHESIVE Henkel Kommanditgesellschaft auf Aktien (DE) 1999-03-31 EP disclosed
WO-1997046630-A1 CYANACRYLATE ADHESIVE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1997-12-11 WO disclosed