SCHEMBL6603513

SCHEMBL6603513

COc1nn(-c2ccc(NC(=O)c3c(C)cc(C)cc3C)cc2)c(=O)o1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.64
LIPC P11150 1/20 0.64
LIPE Q05469 1/20 0.64
ABHD16A O95870 2/20 0.52
MGLL Q99685 4/20 0.49
FAAH O00519 3/20 0.49
MAPT P10636 3/20 0.42
TP53 P04637 1/20 0.42
RIPK1 Q13546 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.41
POLB P06746 1/20 0.41
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL6604642 0.81 LPL (0.62) LPLLIPCLIPEABHD16AMGLL
SCHEMBL6602937 0.81 ABHD16A (0.60) LPLLIPCLIPEABHD16AMGLL
SCHEMBL7044266 0.78 LPL (0.70) LPLLIPCLIPEABHD16AMGLL
SCHEMBL7047919 0.78 LPL (1.00) LPLLIPCLIPEABHD16AMGLL
SCHEMBL6604889 0.78 LPL (0.72) LPLLIPCLIPEABHD16AMGLL
SCHEMBL6600553 0.77 LPL (0.62) LPLLIPCLIPEABHD16AMGLL
SCHEMBL2235103 0.76 ABHD16A (0.74) LPLLIPCLIPEABHD16AMGLL
SCHEMBL6602780 0.76 LPL (0.74) LPLLIPCLIPEABHD16AMGLL
SCHEMBL6603718 0.75 LPL (0.69) LPLLIPCLIPEABHD16AMGLL
SCHEMBL6601943 0.75 LPL (0.72) LPLLIPCLIPEABHD16AMGLL

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
EP-1263745-B1 SUBSTITUTED 3-PHENYL-5-ALKOXI-1,3,4-OXDIAZOL-2-ONE AND USE THEREOF FOR INHIBITING HORMONE-SENSITIVE LIPASE AVENTIS PHARMA GMBH (DE) 2004-05-19 EP disclosed