SCHEMBL7199235

SCHEMBL7199235

CC(OC1CCN(C(=O)c2cc3c(O)cccc3[nH]2)CC1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 3/20 0.62
GRIN3B O60391 3/20 0.62
GRIN1 Q05586 3/20 0.62
GRIN2A Q12879 3/20 0.62
GRIN2B Q13224 3/20 0.62
GRIN2C Q14957 3/20 0.62
GRIN3A Q8TCU5 3/20 0.62
HRH4 Q9H3N8 7/20 0.59
AKR1C3 P42330 2/20 0.46
MAPT P10636 1/20 0.43

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
SCHEMBL7171812 0.82 GRIN2D (0.68) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7169459 0.79 GRIN2D (0.74) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7158407 0.77 GRIN2D (1.00) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7160016 0.76 GRIN2D (0.72) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29979972 0.75 CHRM2 (0.49) GRIN2B
SCHEMBL18429013 0.75 CHRM2 (0.49) GRIN2B
SCHEMBL27283741 0.73 KMT2A (0.51) GRIN2B
SCHEMBL27258963 0.72 SRD5A1 (0.48) GRIN2B
SCHEMBL27393302 0.70 BLM (0.51) GRIN2B
SCHEMBL16599052 0.69 HRH4 (0.71) HRH4

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-1328514-A1 AMIDE DERIVATIVES AS NMDA RECEPTOR ANTAGONISTS RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 2003-07-23 EP disclosed
WO-2002034718-A1 AMIDE DERIVATIVES AS NMDA RECEPTOR ANTAGONISTS RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 2002-05-02 WO disclosed