SCHEMBL4605079

SCHEMBL4605079

CCC1(OC)CCCCC1=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 2/20 0.38
GRIN2A Q12879 2/20 0.38
GRIN2B Q13224 2/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL8654847 0.78 GRIN2D (0.35) GRIN1GRIN2AGRIN2BGRIN2DGRIN3B
SCHEMBL15375840 0.75 CPB2 (0.31)
SCHEMBL16283884 0.72 GRIN2D (0.31) GRIN1GRIN2AGRIN2BGRIN2DGRIN3B
SCHEMBL1254598 0.72 MAPT (0.31) TSHR
SCHEMBL3676099 0.70 GRIN1 (0.34) GRIN1GRIN2AGRIN2BGRIN2DGRIN3B
SCHEMBL2692225 0.70 GRIN1 (0.42) GRIN1GRIN2AGRIN2BGRIN2DGRIN3B
SCHEMBL8315536 0.68 CYP19A1 (0.33) GRIN1GRIN2AGRIN2BGRIN2DGRIN3B
SCHEMBL23168690 0.68 GRIN1 (0.33) GRIN1GRIN2AGRIN2BGRIN2DGRIN3B
SCHEMBL15658952 0.68 GRIN1 (0.41) GRIN1GRIN2AGRIN2BGRIN2DGRIN3B
SCHEMBL3531548 0.68 GRIN1 (0.41) GRIN1GRIN2AGRIN2BGRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1943218-B1 ALKOXYALKYL SPIROCYCLIC TETRAMIC ACIDS AND TETRONIC ACIDS BAYER IP GMBH (DE) 2015-05-06 EP disclosed
EP-1943218-A2 ALKOXYALKYL SPIROCYCLIC TETRAMIC ACIDS AND TETRONIC ACIDS Bayer CropScience AG (DE) 2008-07-16 EP disclosed
WO-2007048545-A2 ALKOXYALKYL SPIROCYCLIC TETRAMIC ACIDS AND TETRONIC ACIDS BAYER CROPSCIENCE AG (DE) 2007-05-03 WO disclosed