SCHEMBL4929942

SCHEMBL4929942

NCC(=O)OC(CC(=O)O)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.38
LMNA P02545 1/20 0.38
GLRA1 P23415 1/20 0.38
SLC6A9 P48067 1/20 0.38
OR51E2 Q9H255 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
SLC22A6 Q4U2R8 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CACNA2D1 P54289 2/20 0.32
CACNB3 P54284 1/20 0.32
CACNA1C Q13936 1/20 0.32
PGR P06401 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
CACNA2D2 Q9NY47 1/20 0.32
ACE P12821 1/20 0.32
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31

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
SCHEMBL7870396 0.80 OR51E2 (0.33) GLRA1SLC6A9OR51E2ACE
SCHEMBL2590042 0.80 TDP1 (0.39) TDP1SMN1; SMN2SLC22A6ACEMMP1
SCHEMBL18832116 0.79 MGAM (0.43) GABRR1LMNATDP1SMN1; SMN2MMP1
SCHEMBL19846190 0.78 MEN1 (0.38) LMNATDP1SMN1; SMN2SLC22A6MMP1
SCHEMBL9782161 0.78 TSHR (0.38) TDP1SMN1; SMN2SLC22A6ACEMMP1
SCHEMBL14918020 0.78 MEN1 (0.38) LMNATDP1SMN1; SMN2SLC22A6MMP1
SCHEMBL6753714 0.78 ACE (0.42) LMNATDP1SMN1; SMN2SLC22A6ACE
SCHEMBL18668788 0.78 SMN1; SMN2 (0.37) GABRR1GLRA1SLC6A9OR51E2TDP1
SCHEMBL6053180 0.77 SMN1; SMN2 (0.56) GABRR1LMNAOR51E2TDP1SMN1; SMN2
SCHEMBL27499132 0.77 GABRR1 (0.31) GABRR1GLRA1SLC6A9OR51E2ACE

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
US-9549959-B2 Animal chew toy containing solid food I DID IT, INC. (US) 2017-01-24 US disclosed
US-8703174-B2 Joint preserving nutritional vitamin, mineral and herbal pet supplement I DID IT INC (US) 2014-04-22 US disclosed
US-20080314333-A1 Animal chew toy containing solid food IDIDIT, INC. 2008-12-25 US disclosed
US-20080069862-A1 Joint preserving nutritional vitamin, mineral and herbal pet supplement IDIDIT, INC. 2008-03-20 US disclosed