SCHEMBL8552629

SCHEMBL8552629

O=C(Nc1ccc(C2CC(F)CCN2C(=O)OCc2ccccc2)c(F)c1)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 11/20 0.48
TMEM97 Q5BJF2 9/20 0.48
MGLL Q99685 1/20 0.46

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
SCHEMBL4688897 0.85 MGLL (0.46) MGLL
SCHEMBL6399085 0.78 MGLL (0.51) MGLL
SCHEMBL28931158 0.77 SMN1; SMN2 (0.50) SIGMAR1TMEM97
SCHEMBL28681054 0.77 SMN1; SMN2 (0.50) SIGMAR1TMEM97
SCHEMBL28681053 0.77 SMN1; SMN2 (0.50) SIGMAR1TMEM97
SCHEMBL5592154 0.77 MGLL (0.54) MGLL
SCHEMBL29891977 0.76 SIGMAR1 (0.49) SIGMAR1TMEM97
SCHEMBL6500495 0.76 MGLL (0.41) MGLL
SCHEMBL6398041 0.75 CALML3 (0.49) SIGMAR1TMEM97
SCHEMBL6398050 0.75 CALML3 (0.49) SIGMAR1TMEM97

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0856002-A1 PHENYLOXAZOLIDINONES HAVING A C-C BOND TO 4-8 MEMBERED HETEROCYCLIC RINGS PHARMACIA & UPJOHN COMPANY (US) 1998-08-05 EP disclosed
WO-1997009328-A1 PHENYLOXAZOLIDINONES HAVING A C-C BOND TO 4-8 MEMBERED HETEROCYCLIC RINGS PHARMACIA & UPJOHN COMPANY (US) 1997-03-13 WO disclosed