SCHEMBL7051648

SCHEMBL7051648

C=CC(=O)OCOC(=O)CC(C)=O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.45
MGAM O43451 2/20 0.44
GAA P10253 2/20 0.44
SI P14410 2/20 0.44
MGAM2 Q2M2H8 2/20 0.44
HPGD P15428 1/20 0.44
ALDH1A1 P00352 6/20 0.43
TP53 P04637 3/20 0.43
HIF1A Q16665 3/20 0.43
CYP3A4 P08684 2/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
THRB P10828 3/20 0.37

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
SCHEMBL7559373 0.87 TSHR (0.50) TSHRMGAMGAASIMGAM2
SCHEMBL218670 0.86 TSHR (0.57) TSHRMGAMGAASIMGAM2
SCHEMBL271812 0.82 TSHR (0.64) TSHRMGAMGAASIMGAM2
SCHEMBL295847 0.82 TSHR (0.59) TSHRMGAMGAASIMGAM2
SCHEMBL2184225 0.82 MGAM (0.63) TSHRMGAMGAASIMGAM2
SCHEMBL268400 0.82 TSHR (0.59) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL12394965 0.81 TSHR (0.68) TSHRMGAMGAASIMGAM2
SCHEMBL11996075 0.81 TSHR (0.68) TSHRMGAMGAASIMGAM2
SCHEMBL12394981 0.81 TSHR (0.68) TSHRMGAMGAASIMGAM2
SCHEMBL9923834 0.81 TSHR (0.68) TSHRMGAMGAASIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110945038-A Aqueous polymer dispersions 陶氏环球技术有限责任公司 2020-03-31 CN disclosed
EP-1034229-B1 COATING COMPOSITIONS CONTAINING A HIGHLY FLUORINATED POLYMERIC ADDITIVE DU PONT (US) 2003-05-07 EP disclosed
US-6429251-B2 AQUEOUS POLYMER DISPERSION WACKER POLYMER SYSTEMS GMBH & CO. KG (DE) 2002-08-06 US disclosed
US-20010025078-A1 Polyvinyl alcohol-stabilized 1,3-diene/ (meth)acrylate copolymers WACKER POLYMER SYSTEMS GMBH & CO. KG 2001-09-27 US disclosed
EP-1034229-A1 COATING COMPOSITIONS CONTAINING A HIGHLY FLUORINATED POLYMERIC ADDITIVE E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-09-13 EP disclosed
US-5948851-A HYDROXY-CONTAINING ACRYLIC COPOLYMER, FLUORINATED ACRYLIC COPOLYMER, CROSSLINKING AGENT E. I. DU PONT DE NEMOURS AND COMPANY (US) 1999-09-07 US disclosed
WO-1999027025-A1 COATING COMPOSITIONS CONTAINING A HIGHLY FLUORINATED POLYMERIC ADDITIVE E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-06-03 WO disclosed