SCHEMBL8630668

SCHEMBL8630668

NP(N)(=O)NC(=O)COc1cccc(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.55
GAA P10253 2/20 0.54
NOTUM Q6P988 2/20 0.54
TP53 P04637 1/20 0.54
ALOX12 P18054 1/20 0.54
ALDH1A1 P00352 3/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.49
POLB P06746 1/20 0.49
MAOB P27338 2/20 0.49
AOC3 Q16853 1/20 0.49
ADAMTS5 Q9UNA0 1/20 0.48
FKBP1A P62942 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL22227971 0.83 ALDH1A1 (0.66) WDR5GAANOTUMTP53ALOX12
SCHEMBL30602658 0.83 ALDH1A1 (0.66) WDR5GAANOTUMTP53ALOX12
SCHEMBL8633936 0.82 L3MBTL1 (0.53) ALDH1A1LMNAMAPTL3MBTL1RAB9A
SCHEMBL8629515 0.81 ATF4 (0.56) ALDH1A1L3MBTL1NPC1RAB9AKDM4E
SCHEMBL8428158 0.80 GAA (0.58) WDR5GAANOTUMTP53ALOX12
SCHEMBL9205693 0.78 WDR5 (0.70) WDR5GAANOTUMTP53ALOX12
SCHEMBL8251623 0.77 SMN1; SMN2 (0.62) WDR5GAANOTUMTP53ALOX12
SCHEMBL1308577 0.76 WDR5 (0.62) WDR5GAANOTUMTP53ALOX12
SCHEMBL29447016 0.76 LMNA (0.64) WDR5GAATP53ALOX12LMNA
SCHEMBL523934 0.76 LMNA (0.64) WDR5GAATP53ALOX12LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5840917-A ADMINISTERING TO MAMMAL TO ERADICATE HELICOBACTER PYLORI TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-11-24 US disclosed
WO-1998042347-A1 PHARMACEUTICAL COMPOSITION CONTAINING A PHOSPHORYLAMIDE AND AN AYNTIBIOTIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-01 WO disclosed
EP-0852498-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE Takeda Chemical Industries, Ltd. (JP) 1998-07-15 EP disclosed
WO-1997011705-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-04-03 WO disclosed