SCHEMBL9011908

SCHEMBL9011908

CCOc1ccc(OCCCc2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.60
SIGMAR1 Q99720 1/20 0.57
LTA4H P09960 2/20 0.57
DRD2 P14416 1/20 0.56
DRD4 P21917 1/20 0.56
DRD3 P35462 1/20 0.56
MAPT P10636 2/20 0.55
LMNA P02545 1/20 0.55
GAA P10253 1/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
CHRNB4 P30926 1/20 0.54
CHRNA3 P32297 1/20 0.54
CHRNA7 P36544 1/20 0.54
NQO1 P15559 1/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL28039326 0.90 NPC1 (0.67) FFAR1SIGMAR1LTA4HMAPTGAA
SCHEMBL12040583 0.89 SIGMAR1 (0.61) FFAR1SIGMAR1LTA4HMAPTLMNA
SCHEMBL16803105 0.87 FFAR1 (0.63) FFAR1LTA4HDRD2DRD4DRD3
SCHEMBL4885846 0.87 FFAR1 (0.63) FFAR1LTA4HDRD2DRD4DRD3
SCHEMBL839323 0.86 DRD2 (0.71) FFAR1DRD2DRD4DRD3GAA
SCHEMBL27258307 0.85 FFAR1 (0.61) FFAR1LTA4HDRD2DRD4DRD3
SCHEMBL12031489 0.85 DRD2 (0.66) FFAR1DRD2DRD4DRD3GAA
SCHEMBL11289148 0.82 LTA4H (0.66) FFAR1LTA4HLMNANPC1RAB9A
SCHEMBL7549790 0.82 LTA4H (0.66) FFAR1LTA4HDRD2DRD4DRD3
SCHEMBL9523628 0.82 DRD2 (0.68) SIGMAR1DRD2DRD4DRD3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5512567-A KAPPA-RECEPTOR AGONISTS SANKYO COMPANY, LIMITED (JP) 1996-04-30 US disclosed