SCHEMBL8769191

SCHEMBL8769191

Cc1c(C)n(CC(=O)O)c(=O)[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 4/20 0.43
GRIA2 P42262 4/20 0.43
GRIA4 P48058 4/20 0.43
GRIA3 P42263 3/20 0.43
GRIN2D O15399 2/20 0.43
GRIN3B O60391 2/20 0.43
GRIN1 Q05586 2/20 0.43
GRIN2A Q12879 2/20 0.43
GRIN2B Q13224 2/20 0.43
GRIN2C Q14957 2/20 0.43
GRIN3A Q8TCU5 2/20 0.43
ALDH1A1 P00352 3/20 0.42
APEX1 P27695 2/20 0.39
GAA P10253 1/20 0.36
KDM4E B2RXH2 1/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
STAT3 P40763 1/20 0.33
GRIK5 Q16478 1/20 0.33

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
SCHEMBL13498365 0.75 ALDH1A1 (0.48) GRIA1GRIA2GRIA4GRIA3GRIN2D
SCHEMBL7834509 0.71 HPGD (0.55) ALDH1A1KDM4EKMT2ALMNA
SCHEMBL4184455 0.71 APEX1 (0.47) GRIA1GRIA2GRIA4GRIA3GRIN2D
SCHEMBL6522899 0.71 APEX1 (0.63) GRIA1GRIA2GRIA4GRIA3GRIN2D
SCHEMBL4889955 0.69 TYMP (0.47) GRIA1GRIA2GRIA4GRIA3GRIN2D
SCHEMBL4618373 0.69 KDM4E (0.46) GRIA1GRIA2GRIA4GRIA3GRIN2D
SCHEMBL29251528 0.68 APEX1 (0.53) GRIA1GRIA2GRIA4GRIA3GRIN2D
SCHEMBL29251527 0.68 APEX1 (0.53) GRIA1GRIA2GRIA4GRIA3GRIN2D
SCHEMBL7337432 0.66 APEX1 (0.45) GRIA1GRIA2GRIA4GRIA3GRIN2D
SCHEMBL8377270 0.66 KDM4E (0.64) ALDH1A1APEX1KDM4EMAPK1STAT3

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-0792283-A1 SYNTHESIS OF PEPTIDE NUCLEIC ACIDS (PNAs) AND ANALOGUES VIA SUBMONOMER APPROACH CHIRON CORPORATION (US) 1997-09-03 EP disclosed
WO-1996015143-A1 SYNTHESIS OF PEPTIDE NUCLEIC ACIDS (PNAs) AND ANALOGUES VIA SUBMONOMER APPROACH CHIRON CORPORATION (US) 1996-05-23 WO disclosed