SCHEMBL1668930

SCHEMBL1668930

Cn1nc(C(F)(F)F)nc1CN1CC(Oc2c(F)cc(C3CCN([S+](C)[O-])CC3)cc2F)C1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.31
DRD4 P21917 2/20 0.31
GRM2 Q14416 2/20 0.31

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
SCHEMBL12198406 0.86 SIGMAR1 (0.32) DRD2DRD4GRM2
SCHEMBL1668932 0.84 FPR2 (0.36) DRD2DRD4GRM2
SCHEMBL12198405 0.80 SIGMAR1 (0.35) DRD2DRD4GRM2
SCHEMBL1669279 0.79 GPR119 (0.38)
SCHEMBL1669050 0.78 FPR2 (0.40) DRD2DRD4GRM2
SCHEMBL1668306 0.76 KMT2A (0.43) DRD2DRD4
SCHEMBL1670840 0.74 TEAD1 (0.38) DRD4
SCHEMBL1670715 0.72 GPR119 (0.41)
SCHEMBL12198399 0.69 SIGMAR1 (0.32)
SCHEMBL1668609 0.68 FPR2 (0.37) DRD2DRD4

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-2486033-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2012-08-15 EP disclosed
WO-2011044001-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-04-14 WO disclosed