SCHEMBL904524

SCHEMBL904524

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

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.55
ALDH1A1 P00352 5/20 0.44
TP53 P04637 3/20 0.44
HIF1A Q16665 3/20 0.44
CYP3A4 P08684 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPK1 P28482 1/20 0.44
HSD17B10 Q99714 1/20 0.43
HPGD P15428 1/20 0.39
THRB P10828 2/20 0.33
PDE4A P27815 1/20 0.30
USP2 O75604 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL11207915 1.00 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL4282346 1.00 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL8965695 0.91 TSHR (0.64) TSHRALDH1A1TP53HIF1ACYP3A4
Pentane SCHEMBL2910734 0.89 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL2476532 0.88 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL1160693 0.88 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL26391489 0.88 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL304806 0.88 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL307713 0.88 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL4272233 0.88 TSHR (0.52) 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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106459316-B Photocurable resin composition 株式会社东进世美肯 2020-03-17 CN claimed
US-8936898-B2 Photosensitive resin composition for imprinting process and method for forming organic layer over substrate LG DISPLAY CO., LTD. (KR) 2015-01-20 US claimed
EP-2244953-B1 PACKAGING SOLUTIONS BAUSCH & LOMB (US) 2011-10-05 EP 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
CN-101484481-A Hydrophilic macromonomers having alpha, beta-conjugated carboxyl end groups and medical devices comprising the same BAUSCH & LOMB (US) 2009-07-15 CN 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
US-7524889-B2 Light emitting diode curable acrylates with reduced yellowing BISCO, INC. (US) 2009-04-28 US claimed
EP-2049066-A2 LIGHT EMITTING DIODE CURABLE ACRYLATES WITH REDUCED YELLOWING Bisco, Inc. (US) 2009-04-22 EP claimed
US-20080009557-A1 Light emitting diode curable acrylates with reduced yellowing BISCO, INC. (US) 2008-01-10 US 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
WO-2008006047-A2 LIGHT EMITTING DIODE CURABLE ACRYLATES WITH REDUCED YELLOWING BISCO, INC. (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
WO-2007021256-A1 ACRYLATE DENTAL COMPOSITIONS WITH IMPROVED VISCOSITY AND STORAGE ODOR BISCO, INC. (US) 2007-02-22 WO claimed
US-20050288387-A1 Acrylate dental compositions with improved viscosity and storage odor BISCO, INC. 2005-12-29 US claimed