SCHEMBL3317773

SCHEMBL3317773

C=C(C)C(=O)OC(CC)Cn1c(=O)n(CC(O)CC)c(=O)n(CC(O)CC)c1=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.32
TSHR P16473 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
SCHEMBL150975 0.93 SLC18A3 (0.35) SLC18A3TSHR
SCHEMBL24495842 0.88 SLC18A3 (0.33) SLC18A3TSHR
SCHEMBL24495794 0.86 SLC18A3 (0.32) SLC18A3TSHR
SCHEMBL24495820 0.84 SLC18A3 (0.33) SLC18A3TSHR
SCHEMBL24495894 0.83 CYP3A4 (0.43) SLC18A3
SCHEMBL24495797 0.82 SLC18A3 (0.30) SLC18A3
SCHEMBL338693 0.81 SLC18A3 (0.30) SLC18A3
SCHEMBL11738039 0.81 SLC18A3 (0.31) SLC18A3
SCHEMBL11738501 0.81 SLC18A3 (0.31) SLC18A3
SCHEMBL24506310 0.80

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-8414979-B2 Radiation-curable resin composition, radiation-curable coating material, and method for forming protective layer DIC CORPORATION (JP) 2013-04-09 US disclosed
US-20100104765-A1 RADIATION-CURABLE RESIN COMPOSITION, RADIATION-CURABLE COATING MATERIAL, AND METHOD FOR FORMING PROTECTIVE LAYER DIC CORPORATION (JP) 2010-04-29 US disclosed
EP-2133374-A1 ACTIVE ENERGY RAY-CURABLE RESIN COMPOSITION, ACTIVE ENERGY RAY-CURABLE COATING MATERIAL, AND METHOD FOR FORMING PROTECTIVE LAYER DIC Corporation (JP) 2009-12-16 EP disclosed