SCHEMBL4668903

SCHEMBL4668903

O=C(NN1CCCCC1)c1ccc2c(c1)N=Cc1c(cccc1-c1ccc(Cl)cc1)S2

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 17/20 0.54
CNR2 P34972 3/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PKM P14618 1/20 0.40

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
SCHEMBL4746902 0.82 PHGDH (0.37) CNR1CNR2
SCHEMBL14205956 0.81 CNR1 (0.66) CNR1CNR2
SCHEMBL5057268 0.81 CNR1 (0.66) CNR1CNR2
SCHEMBL14043684 0.80 CNR1 (0.65) CNR1CNR2
SCHEMBL5576871 0.78 CNR1 (0.69) CNR1CNR2SMN1; SMN2
SCHEMBL4671450 0.77 LMNA (0.47) CNR1NPC1RAB9ASMN1; SMN2
SCHEMBL5057212 0.77 CNR1 (0.73) CNR1CNR2
SCHEMBL14043954 0.77 CNR1 (0.55) CNR1CNR2
SCHEMBL5058668 0.76 CNR1 (0.65) CNR1CNR2
SCHEMBL14206245 0.76 CNR1 (0.65) CNR1CNR2

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-1937677-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE Arcadia Pharmaceuticals Inc. (US) 2008-07-02 EP disclosed
WO-2007047737-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2007-04-26 WO disclosed