SCHEMBL6567098

SCHEMBL6567098

COc1cc(CC(=O)Nc2cccc(C=Cc3cccc(C)c3)c2)ccc1OCCN

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.56
LMNA P02545 7/20 0.56
HTT P42858 4/20 0.56
NPSR1 Q6W5P4 4/20 0.56
TSHR P16473 3/20 0.56
MAPK1 P28482 3/20 0.56
HSD17B10 Q99714 3/20 0.56
MAPT P10636 3/20 0.56
ALDH1A1 P00352 3/20 0.56
STAT3 P40763 2/20 0.56
TP53 P04637 2/20 0.56
HPGD P15428 2/20 0.56
XBP1 P17861 1/20 0.56
HTR1E P28566 1/20 0.56
NTSR1 P30989 1/20 0.56
STAT1 P42224 1/20 0.56
S1PR3 Q99500 1/20 0.56
KMT2A Q03164 2/20 0.53
EPHX2 P34913 1/20 0.52
FBP1 P09467 2/20 0.51

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
SCHEMBL6567092 1.00 SMN1; SMN2 (0.56) SMN1; SMN2LMNAHTTNPSR1TSHR
Hydrochloric Acid SCHEMBL6101760 0.99 SMN1; SMN2 (0.55) SMN1; SMN2LMNAHTTNPSR1TSHR
Hydrochloric Acid SCHEMBL6101765 0.99 SMN1; SMN2 (0.55) SMN1; SMN2LMNAHTTNPSR1TSHR
SCHEMBL6099523 0.89 SMN1; SMN2 (0.61) SMN1; SMN2LMNAHTTNPSR1TSHR
Hydrochloric Acid SCHEMBL6100925 0.88 SMN1; SMN2 (0.60) SMN1; SMN2LMNAHTTNPSR1TSHR
SCHEMBL6099785 0.84 SMN1; SMN2 (0.50) SMN1; SMN2LMNAHTTNPSR1TSHR
SCHEMBL6099791 0.84 SMN1; SMN2 (0.50) SMN1; SMN2LMNAHTTNPSR1TSHR
SCHEMBL6101654 0.81 SMN1; SMN2 (0.63) SMN1; SMN2LMNAHTTNPSR1TSHR
SCHEMBL6098863 0.81 SMN1; SMN2 (0.56) SMN1; SMN2LMNAHTTNPSR1TSHR
SCHEMBL6100933 0.81 SMN1; SMN2 (0.63) SMN1; SMN2LMNAHTTNPSR1TSHR

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-1403235-A1 N-ARYLPHENYLACETAMIDE DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Dainippon Pharmaceutical Co., Ltd. (JP) 2004-03-31 EP disclosed