SCHEMBL8207640

SCHEMBL8207640

COC(=O)c1ccc(C(=O)Nc2sc3c(c2C(=O)NCc2ccc4c(c2)OCO4)CCCC3)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.65
ALDH1A1 P00352 4/20 0.65
HPGD P15428 4/20 0.65
GAA P10253 3/20 0.65
POLB P06746 3/20 0.65
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
USP2 O75604 1/20 0.65
ALOX15 P16050 1/20 0.65
TSHR P16473 1/20 0.65
CASP1 P29466 1/20 0.65
RAB9A P51151 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
HSD17B10 Q99714 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
MGAM O43451 6/20 0.64
AMY1A P0DUB6 4/20 0.64
FLT3 P36888 1/20 0.61
LMNA P02545 3/20 0.54
MAPT P10636 3/20 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
SCHEMBL7889391 0.90 KMT2A (0.68) KDM4EALDH1A1HPGDGAAPOLB
SCHEMBL8207966 0.85 MAPT (0.74) KDM4EALDH1A1HPGDGAAPOLB
SCHEMBL8211459 0.84 MGAM (0.77) KDM4EALDH1A1HPGDGAAMEN1
SCHEMBL8213046 0.83 MGAM (0.73) KDM4EALDH1A1HPGDGAAMEN1
SCHEMBL8206341 0.83 CNR2 (0.55) KDM4EALDH1A1HPGDGAAPOLB
SCHEMBL8199918 0.82 MGAM (0.64) KDM4EALDH1A1HPGDGAAPOLB
SCHEMBL8208112 0.81 MEN1 (0.61) KDM4EALDH1A1HPGDGAAPOLB
SCHEMBL8212882 0.81 MGAM (0.64) KDM4EALDH1A1HPGDGAAPOLB
SCHEMBL7426573 0.81 KDM4E (0.61) KDM4EALDH1A1HPGDGAAPOLB
SCHEMBL8210395 0.80 TDP1 (0.58) KDM4EALDH1A1HPGDMEN1KMT2A

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
US-6143777-A ENZYME INHIBITORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-11-07 US disclosed