SCHEMBL8639229

SCHEMBL8639229

COc1ccccc1CC(=O)Nc1ccccc1C(N)=O

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.71
MAPK8 P45983 2/20 0.69
TSHR P16473 2/20 0.67
KDM4E B2RXH2 2/20 0.65
ALDH1A1 P00352 1/20 0.65
HSD17B10 Q99714 1/20 0.65
GAA P10253 4/20 0.62
GFER P55789 1/20 0.60
LMNA P02545 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
ATM Q13315 1/20 0.56
MAPK9 P45984 1/20 0.54
MAPK10 P53779 1/20 0.54

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
SCHEMBL10340271 0.89 KDM4E (0.77) MAPTMAPK8TSHRKDM4EALDH1A1
SCHEMBL10340210 0.89 MAPT (0.71) MAPTMAPK8TSHRKDM4EALDH1A1
SCHEMBL8639959 0.86 KDM4E (0.60) MAPTMAPK8TSHRKDM4EALDH1A1
SCHEMBL10340244 0.84 MAPK8 (0.62) MAPTMAPK8TSHRKDM4EALDH1A1
SCHEMBL31239080 0.82 NPC1 (0.70) MAPTTSHRKDM4EALDH1A1HSD17B10
SCHEMBL8637152 0.81 GAA (0.64) KDM4EGAAGFERLMNASMN1; SMN2
SCHEMBL8638027 0.80 MEN1 (0.67) MAPTKDM4EALDH1A1GAAGFER
SCHEMBL22340657 0.80 TSHR (0.75) MAPTTSHRKDM4EHSD17B10GAA
SCHEMBL2364548 0.80 MAPT (0.69) MAPTTSHRKDM4EALDH1A1HSD17B10
SCHEMBL8636686 0.78 MAPK8 (0.67) MAPK8KDM4EALDH1A1GAALMNA

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-0855387-A1 2-ACYLAMINOBENZAMIDE DERIVATIVES AND PREVENTIVE AND REMEDY FOR DISEASES CAUSED BY THE SUPERMULTIPLICATION OF VASCULAR INTIMAL CELLS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1998-07-29 EP disclosed