SCHEMBL13770580

SCHEMBL13770580

C=C(N)Cc1ccccc1/C(N)=N/O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.43
LMNA P02545 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GFER P55789 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
ALDH1A1 P00352 1/20 0.32
PKM P14618 1/20 0.32
CTBP2 P56545 2/20 0.31
BCAT2 O15382 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
SCHEMBL871585 0.80 BCAT2 (0.51) GAALMNAL3MBTL1MAPTCTBP2
SCHEMBL19153981 0.80 BCAT2 (0.51) GAALMNAL3MBTL1MAPTCTBP2
Water SCHEMBL871348 0.79 BCAT2 (0.50) GAALMNAL3MBTL1MAPTCTBP2
SCHEMBL7459186 0.79 GAA (0.47) GAALMNAL3MBTL1GFERSMN1; SMN2
SCHEMBL6525138 0.77 PKM (0.41) LMNASMN1; SMN2HTTPKM
SCHEMBL103624 0.77 GAA (0.46) GAALMNAL3MBTL1GFERSMN1; SMN2
SCHEMBL103625 0.77 GAA (0.46) GAALMNAL3MBTL1GFERSMN1; SMN2
SCHEMBL6401722 0.76 FOLH1 (0.52) GAASMN1; SMN2MAPTHTTALDH1A1
SCHEMBL21163691 0.73 LMNA (0.44) GAALMNAL3MBTL1GFERSMN1; SMN2
SCHEMBL10535293 0.70 AKR1B1 (0.56) LMNAL3MBTL1SMN1; SMN2MAPTALDH1A1

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
WO-2009085072-A1 COMPOSITION COMPRISING CHELATING AGENTS CONTAINING AMIDOXIME COMPOUNDS EKC TECHNOLOGY, INC (US) 2009-07-09 WO disclosed