SCHEMBL4893053

SCHEMBL4893053

C=C(C#N)C(=O)OC(C)OCCOC

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL4888281 0.85 ALDH1A1 (0.49) ALDH1A1TSHR
SCHEMBL11802505 0.85 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL4889694 0.84 ALDH1A1 (0.49) ALDH1A1TSHR
SCHEMBL9058082 0.84 ALDH1A1 (0.43) ALDH1A1TSHR
SCHEMBL11806313 0.83 ALDH1A1 (0.40) ALDH1A1TSHR
SCHEMBL4888227 0.83 ALDH1A1 (0.44) ALDH1A1TSHR
SCHEMBL4891378 0.83 TSHR (0.46) ALDH1A1TSHR
SCHEMBL35728 0.81 ALDH1A1 (0.47) ALDH1A1TSHR
SCHEMBL462000 0.81 ALDH1A1 (0.56) ALDH1A1TSHR
SCHEMBL4891423 0.81 ALDH1A1 (0.45) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113318068-A Cyanoacrylate composition, preparation method and application thereof, and transdermal drug delivery preparation 广州武州制药有限公司 2021-08-31 CN claimed
CN-113318068-A Cyanoacrylate composition, preparation method and application thereof, and transdermal drug delivery preparation 广州武州制药有限公司 2021-08-31 CN disclosed
US-20080293872-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2008-11-27 US disclosed
US-20080287574-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2008-11-20 US disclosed