SCHEMBL9240799

SCHEMBL9240799

OCCCCCCCCCCCCCCCCCCC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 4/20 0.61
GRIN3B O60391 4/20 0.61
GRIN1 Q05586 4/20 0.61
GRIN2A Q12879 4/20 0.61
GRIN2B Q13224 4/20 0.61
GRIN2C Q14957 4/20 0.61
GRIN3A Q8TCU5 4/20 0.61
GBA1 P04062 2/20 0.49
GBA2 Q9HCG7 2/20 0.49
EPHX2 P34913 10/20 0.48
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL24728057 0.98 GRIN2D (0.64) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1758688 0.90 GRIN2D (0.62) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10957944 0.87 GRIN2D (0.76) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL237474 0.82 GRIN2D (0.56) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL58465 0.79 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1149893 0.79 GRIN2D (0.95) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8413718 0.79 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9242137 0.79 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8947159 0.79 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL26625037 0.79 GRIN2D (0.59) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
US-5455072-A Initiation and bonding of diamond and other thin films BENSION ROUVAIN M (US) 1995-10-03 US disclosed
EP-0598361-A1 Initiation and bonding of diamond and other thin films Bension, Rouvain M. (US) 1994-05-25 EP disclosed