SCHEMBL8828056

SCHEMBL8828056

CCOP(=O)(O)CCCN1CCNC(C(=O)O)C1

nearest known ligand 0.74

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 4/20 0.72
GRIN3B O60391 4/20 0.72
GRIN1 Q05586 4/20 0.72
GRIN2A Q12879 4/20 0.72
GRIN2B Q13224 4/20 0.72
GRIN2C Q14957 4/20 0.72
GRIN3A Q8TCU5 4/20 0.72
THRB P10828 2/20 0.72
ALOX15 P16050 2/20 0.72
CYP1A2 P05177 1/20 0.72
CYP2C19 P33261 1/20 0.72
HSD17B10 Q99714 1/20 0.72
LMNA P02545 1/20 0.72
RECQL P46063 1/20 0.72
MAPT P10636 1/20 0.56

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
SCHEMBL9676414 0.90 GRIN2D (0.68) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1557957 0.84 GRIN2D (1.00) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL167788 0.84 GRIN2D (1.00) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6021110 0.84 GRIN2D (1.00) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9749886 0.81 GRIN2D (0.69) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5059534 0.80 GRIN2D (0.77) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL13662562 0.80 GRIN2D (0.67) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1207222 0.76 GRIN2D (0.61) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8828049 0.76 ALOX15 (0.71) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5059538 0.75 GRIN2D (0.69) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5595983-A ANTAGONIST ACTION AT AMINO ACID RECEPTORS, ANTICONVULSANTS BRITISH TECHNOLOGY GROUP LIMITED (GB) 1997-01-21 US disclosed
US-5399693-A Substituted piperazine-2-carboxylic acids and derivatives thereof BRITISH TECHNOLOGY GROUP LIMITED (GB) 1995-03-21 US disclosed
EP-0159889-B1 4-SUBSTITUTED PIPERAZINE-2-CARBOXYLIC ACIDS PROCESS AND PHARMACEUTICAL COMPOSITIONS BTG INTERNATIONAL LIMITED (GB) 1992-09-30 EP disclosed
EP-0159889-A2 4-Substituted piperazine-2-carboxylic acids process and pharmaceutical compositions BTG INTERNATIONAL LIMITED (GB) 1985-10-30 EP disclosed