SCHEMBL2476532

SCHEMBL2476532

C=CC(=O)OC[C@H](O)[C@@H](O)[C@H](O)CO

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.52
ALDH1A1 P00352 4/20 0.41
TP53 P04637 3/20 0.41
HIF1A Q16665 3/20 0.41
CYP3A4 P08684 2/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HPGD P15428 1/20 0.37
LMNA P02545 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PDE4A P27815 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
USP2 O75604 1/20 0.34
SLCO1B1 Q9Y6L6 1/20 0.34
THRB P10828 2/20 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
SCHEMBL307713 1.00 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL304806 0.96 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL1160693 0.96 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL4272233 0.96 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL26391489 0.96 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL28121242 0.94 TSHR (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL12019522 0.94 TSHR (0.50) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL11207915 0.88 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL904524 0.88 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL4282346 0.88 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106543378-A A kind of Asterias amurensis Lutken type slow release slump retaining polycarboxylate water reducer and preparation method thereof 中科院广州化学有限公司南雄材料生产基地 2017-03-29 CN claimed
EP-2244953-B1 PACKAGING SOLUTIONS BAUSCH & LOMB (US) 2011-10-05 EP claimed
CN-101910004-A Packaging solutions BAUSCH & LOMB 2010-12-08 CN claimed
EP-2244953-A2 PACKAGING SOLUTIONS Bausch & Lomb Incorporated (US) 2010-11-03 EP claimed
US-20090294362-A1 STATIONARY PHASE FOR HYDROPHILIC INTERACTION CHROMATOGRAPHY MERCK PATENT GMBH (DE) 2009-12-03 US claimed
WO-2009089206-A2 PACKAGING SOLUTIONS BAUSCH & LOMB INCORPORATED (US) 2009-07-16 WO claimed
US-20090173045-A1 Packaging Solutions LAI YU-CHIN 2009-07-09 US claimed
WO-2009079224-A2 SURFACE MODIFIED BIOMEDICAL DEVICES BAUSCH & LOMB INCORPORATED (US) 2009-06-25 WO claimed
US-20090156745-A1 SURFACE MODIFIED BIOMEDICAL DEVICES LAI YU-CHIN 2009-06-18 US claimed
EP-2061818-A2 HYDROPHILIC MACROMONOMERS HAVING ALPHA, BETA -CONJUGATED CARBOXYLIC TERMINAL GROUP AND MEDICAL DEVICES INCORPORATING SAME Bausch & Lomb Incorporated (US) 2009-05-27 EP claimed
WO-2008005753-A2 HYDROPHILIC MACROMONOMERS HAVING α, β -CONJUGATED CARBOXYLIC TERMINAL GROUP AND MEDICAL DEVICES INCORPORATING SAME BAUSCH & LOMB INCORPORATED (US) 2008-01-10 WO claimed
US-20080003252-A1 Functionalized hydrophilic macromonomers and medical devices incorporating same BAUSCH & LOMB INCORPORATED 2008-01-03 US claimed
US-20080004410-A1 Hydrophilic macromonomers having alpha,beta-conjugated carboxylic terminal group and medical devices incorporating same BAUSCH & LOMB INCORPORATED 2008-01-03 US claimed
US-20090294362-A1 STATIONARY PHASE FOR HYDROPHILIC INTERACTION CHROMATOGRAPHY MERCK PATENT GMBH (DE) 2009-12-03 US disclosed