SCHEMBL8040178

SCHEMBL8040178

COC(=O)c1cc(N)c(C)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.51
▸ ALDH1A1 P00352 5/20 0.50
▸ MAPT P10636 3/20 0.50
▸ GAA P10253 3/20 0.50
▸ HPGD P15428 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ USP2 O75604 2/20 0.50
▸ GLA P06280 1/20 0.50
▸ CASP1 P29466 1/20 0.50
▸ CASP7 P55210 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ CNR2 P34972 1/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ RXFP1 Q9HBX9 1/20 0.49
▸ LMNA P02545 4/20 0.47
▸ L3MBTL1 Q9Y468 3/20 0.47
▸ HTT P42858 1/20 0.47
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46

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
SCHEMBL2114318 0.87 KMT2A (0.61) KDM4EALDH1A1MAPTGAAUSP2
SCHEMBL9077842 0.87 KDM4E (0.58) KDM4EALDH1A1MAPTGAAHPGD
SCHEMBL18031417 0.84 KDM4E (0.53) KDM4EALDH1A1MAPTGAAHPGD
SCHEMBL30418756 0.84 KDM4E (0.53) KDM4EALDH1A1MAPTGAAHPGD
SCHEMBL18969560 0.83 USP2 (0.46) KDM4EALDH1A1MAPTGAAHPGD
SCHEMBL25980683 0.83 USP2 (0.50) KDM4EALDH1A1MAPTGAAHPGD
SCHEMBL18940647 0.83 KDM4E (0.49) KDM4EALDH1A1MAPTGAAHPGD
SCHEMBL751242 0.82 KDM4E (0.53) KDM4EALDH1A1MAPTGAAHPGD
SCHEMBL9333497 0.82 TSHR (0.56) KDM4EALDH1A1MAPTGAAHPGD
SCHEMBL30152705 0.82 KDM4E (0.53) KDM4EALDH1A1MAPTGAAHPGD

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-0987250-A1 INDOLE DICARBOXYLIC ACID DERIVATIVES SHIONOGI & CO., LTD. (JP) 2000-03-22 — — EP disclosed
Send feedback