SCHEMBL7656177

SCHEMBL7656177

COc1nn(-c2ccc(NC(=O)N3CCCCC3)c(C)c2)c(=O)o1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.61
FAAH O00519 2/20 0.61
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54
ABHD16A O95870 2/20 0.46
LPL P06858 1/20 0.45
LIPC P11150 1/20 0.45
LIPE Q05469 1/20 0.45
PKM P14618 1/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
THRB P10828 1/20 0.41

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
SCHEMBL7571649 0.86 MGLL (0.72) MGLLFAAHRAB9ANPC1ABHD16A
SCHEMBL7045989 0.83 MGLL (0.66) MGLLFAAHRAB9ANPC1ABHD16A
SCHEMBL7656723 0.80 MGLL (0.62) MGLLFAAHRAB9ANPC1ABHD16A
SCHEMBL6615026 0.79 MGLL (0.75) MGLLFAAHABHD16ALPLLIPC
SCHEMBL7046095 0.78 MGLL (0.74) MGLLFAAHABHD16ALPLLIPC
SCHEMBL7046445 0.78 MGLL (0.62) MGLLFAAHRAB9ANPC1ABHD16A
SCHEMBL7042329 0.77 MGLL (0.61) MGLLFAAHNPC1ABHD16ALPL
SCHEMBL7046042 0.77 MGLL (0.72) MGLLFAAHABHD16ALPLLIPC
SCHEMBL7046331 0.77 MGLL (0.61) MGLLFAAHRAB9ANPC1ABHD16A
SCHEMBL7044315 0.76 MGLL (0.62) MGLLFAAHABHD16ALPLLIPC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-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 46/4885RAB9A 1930/4885

“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.