SCHEMBL11619464

SCHEMBL11619464

COc1nn(-c2ccc(Cl)cc2OC)c(=O)o1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABHD16A O95870 2/20 0.49
MGLL Q99685 5/20 0.47
FAAH O00519 4/20 0.45
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP3 P42574 1/20 0.41
HTT P42858 1/20 0.41
SENP8 Q96LD8 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
TRPV4 Q9HBA0 1/20 0.38

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
SCHEMBL10826618 0.84 ABHD16A (0.50) ABHD16AMGLLFAAHLMNAMAPT
SCHEMBL31743451 0.84 ABHD16A (0.50) ABHD16AMGLLFAAHLMNAMAPT
SCHEMBL74675 0.80 ABHD16A (0.57) ABHD16AMGLLFAAH
SCHEMBL2233406 0.78 ABHD16A (0.72) ABHD16AMGLLFAAH
SCHEMBL11621778 0.78 ABHD16A (0.52) ABHD16AMGLLFAAHMAPT
SCHEMBL7044246 0.77 ABHD16A (0.48) ABHD16AMGLLFAAHALDH1A1MAPT
SCHEMBL11618467 0.75 FAAH (0.55) ABHD16AMGLLFAAH
SCHEMBL11020550 0.74 ABHD16A (0.45) ABHD16AMGLLFAAHNPC1LMNA
SCHEMBL11620913 0.73 MGLL (0.50) ABHD16AMGLLFAAH
SCHEMBL11620114 0.73 MGLL (0.50) MGLLALDH1A1LMNAMAPTMAPK1

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-4076824-A Anthelmintic oxadiazolinone derivatives RHONE-POULENC INDUSTRIES (FR) 1978-02-28 US disclosed