SCHEMBL19336853

SCHEMBL19336853

CCCCCCCCn1c(=O)n(CCCCCCC)c(=O)n(CCCCCCC(C)(C)C)c1=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 1/20 0.43
CNR2 P34972 7/20 0.43
RGS4 P49798 3/20 0.42
PTGS1 P23219 3/20 0.41
PTGS2 P35354 3/20 0.41
MGLL Q99685 3/20 0.41
FAAH O00519 2/20 0.41
TNF P01375 2/20 0.40
MAPK10 P53779 1/20 0.40
GSK3B P49841 1/20 0.37
RGS8 P57771 1/20 0.37
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
NR2F2 P24468 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL25867919 0.98 RGS4 (0.43) ADORA2BCNR2RGS4PTGS1PTGS2
SCHEMBL15984388 0.92 RGS4 (0.35) ADORA2BCNR2RGS4MGLLFAAH
SCHEMBL19493726 0.89 RGS4 (0.44) CNR2RGS4TNFGSK3BRGS8
SCHEMBL20724125 0.86 RGS4 (0.45) ADORA2BCNR2RGS4GSK3BRGS8
SCHEMBL12787622 0.85 MGLL (0.52) ADORA2BCNR2RGS4PTGS1PTGS2
SCHEMBL11840543 0.85 MGLL (0.52) ADORA2BCNR2RGS4PTGS1PTGS2
SCHEMBL9626274 0.85 MGLL (0.52) ADORA2BCNR2RGS4PTGS1PTGS2
SCHEMBL4963710 0.85 MGLL (0.52) ADORA2BCNR2RGS4PTGS1PTGS2
SCHEMBL19493532 0.84 RGS4 (0.37) ADORA2BCNR2RGS4GSK3B
SCHEMBL19700832 0.84 CNR2 (0.34) ADORA2BCNR2RGS4PTGS1PTGS2

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-2768877-B1 POLYMERISABLE PLASTICISER, LIQUID POLYURETHANE RESIN COMPOSITION COMPRISING SAME AND USES THEREOF SOPREMA (FR) 2017-09-13 EP disclosed
EP-2768878-B1 STABLE, READY-TO-USE LIQUID POLYURETHANE RESIN COMPOSITION AND USES THEREOF SOPREMA (FR) 2017-09-13 EP disclosed