SCHEMBL7044232

SCHEMBL7044232

COc1nn(-c2ccc(NC(=O)OCc3ccccc3)cc2C)c(=O)o1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.68
FAAH O00519 3/20 0.68
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
TSHR P16473 1/20 0.45
ATM Q13315 1/20 0.45
SCD O00767 1/20 0.45
PTPN1 P18031 1/20 0.43
POLB P06746 1/20 0.43
PTGDR2 Q9Y5Y4 4/20 0.43
ROCK2 O75116 1/20 0.42
MAOA P21397 1/20 0.42

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
SCHEMBL7045650 0.90 MGLL (0.61) MGLLFAAHNPC1RAB9ASMN1; SMN2
SCHEMBL29499689 0.81 MGLL (1.00) MGLLFAAHNPC1RAB9ASMN1; SMN2
SCHEMBL7042914 0.81 MGLL (1.00) MGLLFAAHNPC1RAB9ASMN1; SMN2
SCHEMBL7043147 0.78 MGLL (0.81) MGLLFAAHNPC1RAB9A
SCHEMBL7046273 0.75 FAAH (0.60) MGLLFAAHNPC1RAB9AMAPT
SCHEMBL7046374 0.72 MGLL (0.83) MGLLFAAHNPC1RAB9ASMN1; SMN2
SCHEMBL7040893 0.72 MGLL (0.83) MGLLFAAHNPC1RAB9ASMN1; SMN2
SCHEMBL7041423 0.72 LPL (0.55) MGLLFAAHNPC1RAB9ASMN1; SMN2
SCHEMBL3175561 0.72 MGLL (0.60) MGLLNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL7043936 0.72 MGLL (0.82) MGLLFAAHNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030236288-A1 Use of substituted 3-phenyl-5-alkoxy-3H-(1,3,4)-oxadizol-2-ones for inhibiting pancreatic lipase AVENTIS PHARMA DEUTSCHLAND GMBH 2003-12-25 US disclosed
US-6369088-B2 ANTIDIABETIC AGENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-04-09 US disclosed
US-20010031772-A1 Substituted 3-phenyl-5-alkoxy-1,3,4-oxadiazol-2-ones, their preparation and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2001-10-18 US 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 (2 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-20010031772-A1 Substituted 3-phenyl-5-alkoxy-1,3,4-oxadiazol-2-ones, their preparation and their use as pharmaceuticals CNR1, PTGER1, CNR2 MGLL 1542/4885FAAH 46/4885NPC1 622/4885
US-20030236288-A1 Use of substituted 3-phenyl-5-alkoxy-3H-(1,3,4)-oxadizol-2-ones for inhibiting pancreatic lipase PNLIP, CEL, LIPE MGLL 10/4885FAAH 142/4885NPC1 730/4885

“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.