SCHEMBL10296126

SCHEMBL10296126

CCNC(CC)C(=O)NC

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.34
TSHR P16473 1/20 0.34
MMP3 P08254 3/20 0.34
MMP2 P08253 2/20 0.33
MMP9 P14780 2/20 0.33
MMP8 P22894 2/20 0.33
BMP1 P13497 2/20 0.32
LMNA P02545 2/20 0.31
CNR1 P21554 1/20 0.31
ADRA1A P35348 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
FOLH1 Q04609 2/20 0.30
NAALAD2 Q9Y3Q0 2/20 0.30
ABCC3 O15438 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL22567099 0.88 MMP3 (0.40) MMP3MMP2MMP9MMP8BMP1
SCHEMBL13350925 0.84 MMP2 (0.35) USP2TSHRMMP3MMP2MMP9
SCHEMBL11116277 0.82 BMP1 (0.40) MMP3MMP2MMP9MMP8BMP1
SCHEMBL17178036 0.80 BMP1 (0.42) MMP3MMP2BMP1
Hydrochloric Acid SCHEMBL11114588 0.80 BMP1 (0.39) MMP3MMP2MMP9MMP8BMP1
SCHEMBL15834073 0.80
SCHEMBL10296137 0.80
SCHEMBL19245403 0.80
SCHEMBL19488687 0.79 BCHE (0.39) USP2TSHRMMP2
SCHEMBL18271972 0.79 BMP1 (0.37) MMP2MMP9MMP8BMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3184527-A1 2,6-DIOXO,-2,3-DIHYDRO-1H-PURINE COMPOUNDS USEFUL FOR TREATING DISORDERS RELATED TO THE ACTIVITY OF THE TRPA1 CHANNEL Hydra Biosciences, Inc. (US) 2017-06-28 EP disclosed
EP-2471363-A1 Use of aryl-, heteroaryl- and benzylsulfonamide carboxylic acids, -carboxylic acid esters, -carboxylic acid amides and -carbonitriles and/or its salts for increasing stress tolerance in plants Bayer CropScience AG (DE) 2012-07-04 EP disclosed