SCHEMBL3345925

SCHEMBL3345925

O=C(O)N1CCC2(CC1)C[C@@H](c1cc(F)cc(Cl)c1)CO2

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 8/20 0.41
FFAR4 Q5NUL3 3/20 0.39
MDM2 Q00987 2/20 0.34
TP53 P04637 1/20 0.34
OGA O60502 1/20 0.33
NPC1 O15118 1/20 0.33
CACNA1H O95180 2/20 0.32
NPY5R Q15761 1/20 0.32
GRM4 Q14833 1/20 0.32

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
SCHEMBL3345924 1.00 MGLL (0.41) MGLLFFAR4MDM2TP53OGA
SCHEMBL2425356 0.84 MGLL (0.44) MGLLFFAR4
SCHEMBL3346464 0.79 MGLL (0.45) MGLLFFAR4TP53NPC1
SCHEMBL3346469 0.79 MGLL (0.45) MGLLFFAR4TP53NPC1
SCHEMBL2424213 0.78 CACNA1H (0.36) MGLLOGACACNA1H
SCHEMBL18446074 0.77 MGLL (0.50) MGLL
Hydrochloric Acid SCHEMBL2423115 0.77 TRPM5 (0.34)
SCHEMBL2420942 0.76 MGLL (0.48) MGLLFFAR4
SCHEMBL3346282 0.75 MGLL (0.51) MGLLFFAR4OGA
SCHEMBL3350922 0.75 MGLL (0.51) MGLLFFAR4OGA

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
WO-2010058318-A1 1-OXA-8-AZASPIRO [4, 5 ] DECANE- 8 -CARBOXAMIDE COMPOUNDS AS FAAH INHIBITORS PFIZER INC. (US) 2010-05-27 WO disclosed