SCHEMBL4246500

SCHEMBL4246500

COC(=O)c1ccc(NC(=O)c2ccccc2)cc1OC

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.64
MAPK1 P28482 1/20 0.64
HSD17B10 Q99714 1/20 0.64
KMT2A Q03164 6/20 0.63
MEN1 O00255 3/20 0.63
MAPT P10636 3/20 0.63
KCNK9 Q9NPC2 2/20 0.63
KCNK3 O14649 1/20 0.63
RAB9A P51151 6/20 0.62
ATM Q13315 1/20 0.59
LMNA P02545 3/20 0.58
NPC1 O15118 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
NLRP3 Q96P20 1/20 0.57
PTPN1 P18031 1/20 0.57
MCHR1 Q99705 1/20 0.57
HTT P42858 1/20 0.56
IMPDH2 P12268 1/20 0.56
ALDH1A1 P00352 1/20 0.56
TP53 P04637 1/20 0.56

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
SCHEMBL7050973 0.89 KCNK9 (0.67) KDM4EMAPK1HSD17B10KMT2AMEN1
SCHEMBL28438951 0.87 RAB9A (0.68) KDM4EMAPK1HSD17B10KMT2AMEN1
SCHEMBL4250855 0.86 KCNK3 (0.64) KDM4EKMT2AMEN1MAPTKCNK9
SCHEMBL4243038 0.86 RAB9A (0.65) KDM4EMAPK1KMT2AMEN1MAPT
SCHEMBL4238192 0.85 NPC1 (0.68) KDM4EKMT2AMEN1MAPTKCNK9
SCHEMBL5492048 0.85 RAB9A (0.75) KDM4EKMT2AMEN1MAPTKCNK9
SCHEMBL14370169 0.85 KMT2A (0.64) KDM4EKMT2AMEN1MAPTKCNK9
SCHEMBL6993922 0.84 HTT (0.73) KDM4EKMT2AMAPTKCNK9KCNK3
SCHEMBL4241238 0.83 KMT2A (0.68) KDM4EMAPK1HSD17B10KMT2AMEN1
SCHEMBL4238913 0.83 RAB9A (0.66) KDM4EMAPK1HSD17B10KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009071519-A9 OXADIAZOLE DERIVATIVES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2009-12-03 WO disclosed
WO-2009071519-A1 OXADIAZOLE DERIVATIVES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2009-06-11 WO disclosed
US-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 US disclosed
US-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 US disclosed
US-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 US disclosed
WO-2007138033-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2007-12-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA7, CHRNA5, CHRNA2 KDM4E 3074/4885MAPK1 1809/4885HSD17B10 1668/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.