SCHEMBL7518875

SCHEMBL7518875

CN(C)C(C=CC(N)=O)CO

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA4 P43681 1/20 0.33
TDP1 Q9NUW8 1/20 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
SCHEMBL2384820 0.83 CHRNB2 (0.33) CHRNB2CHRNB4CHRNA3CHRNA4TDP1
SCHEMBL2384829 0.83 CHRNB2 (0.33) CHRNB2CHRNB4CHRNA3CHRNA4TDP1
SCHEMBL7610787 0.71
SCHEMBL28422240 0.70 TGFBR1 (0.32)
SCHEMBL1486043 0.69 GABRP (0.30)
SCHEMBL1135129 0.69 GABRP (0.30)
SCHEMBL619201 0.69
SCHEMBL9240887 0.67
SCHEMBL10583046 0.67
SCHEMBL15711051 0.67 CHRNB2 (0.33) CHRNB2CHRNB4CHRNA3CHRNA4

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
EP-1171530-A1 ELECTROCOATING COMPOSITIONS CONTAINING POLYVINYLPYRROLIDONE CRATER CONTROL AGENTS PPG Industries Ohio, Inc. (US) 2002-01-16 EP disclosed
WO-2000064990-A1 ELECTROCOATING COMPOSITIONS CONTAINING POLYVINYLPYRROLIDONE CRATER CONTROL AGENTS PPG INDUSTRIES OHIO, INC. (US) 2000-11-02 WO disclosed
EP-0337422-A2 Waterdilutable binders and their use as coatings especially in the car industry Herberts Gesellschaft mit beschränkter Haftung (DE) 1989-10-18 EP disclosed