SCHEMBL10587782

SCHEMBL10587782

C=CC(CC(=O)c1ccccc1)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
L3MBTL1 Q9Y468 7/20 0.45
MAPT P10636 5/20 0.45
ALDH1A1 P00352 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 3/20 0.45
HPGD P15428 2/20 0.45
KDM4E B2RXH2 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KMT2A Q03164 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
MEN1 O00255 2/20 0.44
MAPK1 P28482 2/20 0.44
CYP3A4 P08684 2/20 0.44
ALOX15 P16050 1/20 0.44
CES1 P23141 1/20 0.44
NPC1 O15118 1/20 0.42
GAA P10253 1/20 0.41
GSK3B P49841 2/20 0.41
TRPA1 O75762 1/20 0.41

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
SCHEMBL2405059 0.79 TSHR (0.53) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL1414563 0.77 TSHR (0.55) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL10587793 0.76 LMNA (0.42) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL7882975 0.75 TSHR (0.53) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL19346894 0.75 L3MBTL1 (0.56) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL7203018 0.75 TSHR (0.53) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL11762210 0.75 TSHR (0.53) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL11088941 0.74 ALDH1A1 (0.53) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL2679188 0.73 TSHR (0.40) TSHRALDH1A1SMN1; SMN2LMNAKMT2A
SCHEMBL28049900 0.73 L3MBTL1 (0.62) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2

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-0300325-A2 Compositions for promoting growth of animals COMETEC S.r.l. (IT) 1989-01-25 EP disclosed