SCHEMBL7657538

SCHEMBL7657538

COc1nn(-c2cccc(NC(C)=O)c2)c(=O)o1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.59
ABHD16A O95870 2/20 0.57
LIPC P11150 2/20 0.51
LIPE Q05469 2/20 0.51
LPL P06858 1/20 0.51
FAAH O00519 2/20 0.50
IDO1 P14902 1/20 0.47
TDO2 P48775 1/20 0.47
ABHD6 Q9BV23 1/20 0.46
GAA P10253 1/20 0.45
POLB P06746 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
CRHBP P24387 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
CRHR2 Q13324 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
SCHEMBL7046524 0.82 MGLL (0.53) MGLLABHD16ALIPCLIPELPL
SCHEMBL7043150 0.79 MGLL (0.63) MGLLABHD16ALIPCLIPEFAAH
SCHEMBL7047523 0.77 MGLL (0.67) MGLLABHD16ALIPCLIPEFAAH
SCHEMBL6601500 0.77 ALDH1A1 (0.51) MGLLABHD16ALIPCLIPELPL
SCHEMBL6601880 0.76 ALDH1A1 (0.54) MGLLABHD16AFAAHGAAALDH1A1
SCHEMBL6552790 0.76 MGLL (0.74) MGLLABHD16ALIPCLIPEFAAH
SCHEMBL11620781 0.75 FAAH (0.78) MGLLABHD16ALIPCLIPELPL
Trifluoroacetic Acid SCHEMBL6601176 0.75 MGLL (0.50) MGLLABHD16ALIPCLIPELPL
Trifluoroacetic Acid SCHEMBL6601602 0.75 MGLL (0.50) MGLLABHD16ALIPCLIPELPL
Trifluoroacetic Acid SCHEMBL6606875 0.75 MGLL (0.50) MGLLABHD16ALIPCLIPELPL

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
US-6369088-B2 ANTIDIABETIC AGENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-04-09 US disclosed