SCHEMBL9570830

SCHEMBL9570830

CC(O)CNC(=O)C=CC(N)=O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GFPT1 Q06210 1/20 0.42
MAP3K7 O43318 2/20 0.38
TAB1 Q15750 2/20 0.38
CNR2 P34972 5/20 0.38
CNR1 P21554 3/20 0.38
PPARG P37231 2/20 0.38
PPARD Q03181 2/20 0.38
PPARA Q07869 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
DDAH1 O94760 1/20 0.37
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
EPHX2 P34913 1/20 0.34
LMNA P02545 1/20 0.33
MCL1 Q07820 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
SCHEMBL9570825 1.00 GFPT1 (0.42) GFPT1MAP3K7TAB1CNR2CNR1
SCHEMBL8897213 0.89 GFPT1 (0.44) GFPT1MAP3K7TAB1CNR2CNR1
SCHEMBL8895482 0.89 GFPT1 (0.44) GFPT1MAP3K7TAB1CNR2CNR1
SCHEMBL7890988 0.86 CNR2 (0.50) GFPT1CNR2CNR1PPARGPPARD
SCHEMBL7890992 0.86 CNR2 (0.50) GFPT1CNR2CNR1PPARGPPARD
SCHEMBL28682924 0.83 GFPT1 (0.41) GFPT1CNR2CNR1PPARGPPARD
SCHEMBL8648273 0.79 CNR2 (0.47) GFPT1MAP3K7TAB1CNR2CNR1
SCHEMBL7772177 0.79 CNR2 (0.47) GFPT1MAP3K7TAB1CNR2CNR1
SCHEMBL1516261 0.76 MAP3K7 (0.35) GFPT1MAP3K7TAB1CNR2CNR1
SCHEMBL13101467 0.74 DDAH1 (0.36) GFPT1CNR2CNR1PPARGPPARD

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-0550008-A2 Use of N-acyl derivatives of aminoalcohols with polycarboxylic acids for the manufacture of a medicament for the treatment of pathologies relating to mast cells LIFEGROUP S.p.A. (IT) 1993-07-07 EP disclosed