SCHEMBL7375815

SCHEMBL7375815

c1ccc(OCCCNC2(c3ccccc3)CCCCC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.62
GRIN3B O60391 2/20 0.62
GRIA1 P42261 2/20 0.62
GRIA2 P42262 2/20 0.62
GRIA3 P42263 2/20 0.62
GRIA4 P48058 2/20 0.62
GRIN1 Q05586 2/20 0.62
GRIN2A Q12879 2/20 0.62
GRIN2B Q13224 2/20 0.62
GRIN2C Q14957 2/20 0.62
GRIN3A Q8TCU5 2/20 0.62
DRD2 P14416 2/20 0.49
DRD4 P21917 2/20 0.49
DRD3 P35462 2/20 0.49
HTR1B P28222 2/20 0.47
HTR1A P08908 7/20 0.46
ADRA1D P25100 7/20 0.46
ADRA1B P35368 7/20 0.46
HTR1D P28221 1/20 0.45
KCNA3 P22001 1/20 0.44

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
SCHEMBL29604371 0.85 GRIN2D (0.62) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL29728985 0.84 GRIN2D (0.61) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL5328724 0.80 GRIN2D (0.68) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL30508946 0.78 GRIN2D (0.57) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL19242786 0.77 GRIN2D (1.00) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL19242653 0.76 GRIN2D (0.55) GRIN2DGRIN3BGRIA1GRIA2GRIA3
Bromide SCHEMBL20501902 0.76 GRIN2D (0.97) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL19242654 0.76 GRIN2D (0.67) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL30151574 0.76 GRIN2D (0.67) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL30534232 0.76 GRIN2D (0.62) GRIN2DGRIN3BGRIA1GRIA2GRIA3

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
WO-1997023202-A1 SUBTYPE-SELECTIVE NMDA RECEPTOR LIGANDS AND THE USE THEREOF STATE OF OREGON, acting by and through THE OREGON STATE BOARD OF HIGHER EDUCATION, acting for and on behalf of THE OREGON HEALTH SCIENCES UNIVERSITYA ND THE UNIVERSITY OF OREGON, EUGENE OREGON (US) 1997-07-03 WO disclosed