SCHEMBL9845480

SCHEMBL9845480

O=C1COc2cc(F)cc3c2N1CCC3O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 1/20 0.33
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
MAOB P27338 2/20 0.30
MAOA P21397 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9845436 0.70 CYP11B1 (0.34) NR3C2
SCHEMBL9845462 0.70 NPC1 (0.38)
SCHEMBL9845457 0.65
SCHEMBL826425 0.62 ALOX5 (0.37)
SCHEMBL829221 0.62 ALOX5 (0.37)
SCHEMBL9827759 0.61 HTR1A (0.41)
SCHEMBL9845452 0.61 MEN1 (0.38) MEN1KMT2A
SCHEMBL23591417 0.58 HTR1A (0.35) MAOBMAOA
SCHEMBL1884238 0.58 CYP11B2 (0.70)
SCHEMBL10909007 0.57 NPC1 (0.39) MEN1KMT2A

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-0406993-A2 Substituted benzoxazolinone and benzoxazinone derivatives, process for their preparation and their use as agent with herbicide activity SCHERING AKTIENGESELLSCHAFT (DE) 1991-01-09 EP disclosed