SCHEMBL4416136

SCHEMBL4416136

CCCc1cccc(/C=C/C2CCCCC2)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.39
DRD1 P21728 1/20 0.39
DRD4 P21917 1/20 0.39
DRD5 P21918 1/20 0.39
DRD3 P35462 1/20 0.39
MAOB P27338 3/20 0.38
MAOA P21397 2/20 0.38
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 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
Ammonia Solution, Strong SCHEMBL27776413 0.99 DRD2 (0.39) DRD2DRD1DRD4DRD5DRD3
SCHEMBL4171897 0.83 GRIN1 (0.37) MAOBMAOAGRIN1GRIN2B
SCHEMBL4171900 0.83 GRIN1 (0.37) MAOBMAOAGRIN1GRIN2B
SCHEMBL4170854 0.83 GRIN1 (0.37) MAOBMAOAGRIN1GRIN2B
SCHEMBL4170861 0.83 GRIN1 (0.37) MAOBMAOAGRIN1GRIN2B
SCHEMBL27776435 0.82 MAOB (0.38) MAOBMAOAGRIN1GRIN2B
SCHEMBL4176470 0.81 HMGCR (0.37) MAOBMAOAGRIN1GRIN2B
SCHEMBL4176473 0.81 HMGCR (0.37) MAOBMAOAGRIN1GRIN2B
SCHEMBL4179717 0.74 TDP1 (0.46) DRD2DRD3
SCHEMBL4179714 0.74 TDP1 (0.46) DRD2DRD3

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-2076124-A2 STYRENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS Acucela, Inc. (US) 2009-07-08 EP claimed
WO-2008131368-A2 STYRENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA INC. (US) 2008-10-30 WO claimed