SCHEMBL11560641

SCHEMBL11560641

COc1ccccc1-n1nc(OC(C)C)oc1=O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABHD16A O95870 1/20 0.46
FAAH O00519 6/20 0.45
MGLL Q99685 5/20 0.45
MEN1 O00255 1/20 0.40
NR1I2 O75469 1/20 0.40
PPOX P50336 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SLC16A3 O15427 1/20 0.39
SLC16A1 P53985 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA1 P30542 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
SCHEMBL74675 0.88 ABHD16A (0.57) ABHD16AFAAHMGLL
SCHEMBL30201257 0.88 ABHD16A (0.57) ABHD16AFAAHMGLL
SCHEMBL2235276 0.82 MGLL (0.54) ABHD16AFAAHMGLLADORA3ADORA1
SCHEMBL11623152 0.82 MGLL (0.40) ABHD16AFAAHMGLLMEN1NR1I2
SCHEMBL11557381 0.80 MGLL (0.44) ABHD16AFAAHMGLL
Phthalimide SCHEMBL19032687 0.79 ABHD16A (0.48) ABHD16AFAAHMGLLMEN1KMT2A
SCHEMBL11558642 0.77 ABHD16A (0.51) ABHD16AFAAHMGLL
SCHEMBL11618257 0.77 MEN1 (0.44) ABHD16AFAAHMGLLMEN1NR1I2
SCHEMBL7807340 0.76 ADORA3 (0.48) MGLLMEN1KMT2AADORA3ADORA1
SCHEMBL11621778 0.75 ABHD16A (0.52) ABHD16AFAAHMGLL

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-4150142-A Derivatives of alkoxy-5-phenyl-3 oxadiazoline-1,3,4 one-2, their preparation and insecticidal and acaricidal compositions which contain them PHILAGRO S.A. (FR) 1979-04-17 US claimed