SCHEMBL9850862

SCHEMBL9850862

Cc1ccc(NNC(=O)O)c(C)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.65
TDP1 Q9NUW8 3/20 0.56
GFER P55789 1/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 2/20 0.51
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.49
LMNA P02545 2/20 0.49
TP53 P04637 1/20 0.49
MAPK1 P28482 2/20 0.48
MAPT P10636 2/20 0.48
HPGD P15428 1/20 0.48
ALOX12 P18054 1/20 0.48
RAPGEF4 Q8WZA2 1/20 0.47
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46

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
SCHEMBL5181334 0.85 GAA (0.55) GAATDP1GFERMEN1KMT2A
Hydrochloric Acid SCHEMBL23145223 0.83 GAA (0.54) GAATDP1GFERMEN1KMT2A
SCHEMBL1241057 0.80 GAA (0.54) GAATDP1GFERMEN1KMT2A
SCHEMBL1199108 0.80 GAA (0.54) GAATDP1GFERMEN1KMT2A
SCHEMBL9224379 0.80 RAPGEF4 (0.60) GAATDP1GFERMEN1KMT2A
SCHEMBL2091371 0.79 MEN1 (0.71) GAAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL14108104 0.79 GAA (0.56) GAATDP1GFERMEN1KMT2A
SCHEMBL12814369 0.78 GAA (0.51) GAATDP1GFERMEN1KMT2A
SCHEMBL7975698 0.78 SMN1; SMN2 (0.50) GAATDP1GFERMEN1KMT2A
Fluoride SCHEMBL11786773 0.78 MEN1 (0.69) GAAMEN1KMT2ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0419918-A2 Substituted 1,3,4-oxa(thia)-diazolinones, process for their preparation and their use in controlling endoparasites BAYER AG (DE) 1991-04-03 EP disclosed