SCHEMBL8020574

SCHEMBL8020574

CN(C(=O)COc1cccc(N(CC(=O)N(C)c2ccccc2)C(=O)CNC(=O)Nc2cccc(CC(=O)O)c2)c1)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.38
PDE5A O76074 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
MAPK1 P28482 1/20 0.36
PPIB P23284 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
TP53 P04637 1/20 0.35
HTT P42858 1/20 0.35
GRM5 P41594 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HPSE Q9Y251 1/20 0.35
MAPT P10636 1/20 0.35
MLYCD O95822 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL8031868 0.92 PPIB (0.38) PDE5ASMN1; SMN2MAPK1PPIBNPC1
SCHEMBL27487343 0.91 ITGB1 (0.34) SMN1; SMN2MAPK1PPIBNPC1RAB9A
SCHEMBL8020628 0.91 KMT2A (0.42) SMN1; SMN2NPC1HTTMEN1KMT2A
SCHEMBL8020901 0.90 SMN1; SMN2 (0.37) PDE5ASMN1; SMN2MAPK1PPIBNPC1
SCHEMBL8031875 0.90 MAPK1 (0.40) PDE5ASMN1; SMN2MAPK1HTTMEN1
SCHEMBL8020648 0.89 KDM4E (0.38) PDE5ASMN1; SMN2MAPK1PPIBNPC1
SCHEMBL8020736 0.89 ITGB1 (0.36) PDE5ASMN1; SMN2MAPK1PPIBNPC1
SCHEMBL8020823 0.88 SMN1; SMN2 (0.40) PDE5ASMN1; SMN2MAPK1PPIBNPC1
SCHEMBL8033859 0.88 SMN1; SMN2 (0.44) PDE5ASMN1; SMN2MAPK1PPIBNPC1
SCHEMBL8029961 0.87 KMT2A (0.38) SMN1; SMN2MAPK1NPC1HTTMEN1

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-0985660-A1 AMINOPHENOL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-03-15 EP disclosed