SCHEMBL8828049

SCHEMBL8828049

CCOP(=O)(O)C=CCN1CCNC(C(=O)O)C1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.71
MAPT P10636 1/20 0.53
GRIN2D O15399 5/20 0.49
GRIN3B O60391 5/20 0.49
GRIN1 Q05586 5/20 0.49
GRIN2A Q12879 5/20 0.49
GRIN2B Q13224 5/20 0.49
GRIN2C Q14957 5/20 0.49
GRIN3A Q8TCU5 5/20 0.49
THRB P10828 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
HSD17B10 Q99714 1/20 0.49
LMNA P02545 1/20 0.49
RECQL P46063 1/20 0.49

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
SCHEMBL9677431 0.89 ALOX15 (0.69) ALOX15MAPTGRIN2DGRIN3BGRIN1
SCHEMBL5058498 0.85 ALOX15 (0.74) ALOX15MAPTGRIN2DGRIN3BGRIN1
Midafotel SCHEMBL726553 0.83 ALOX15 (1.00) ALOX15MAPTGRIN2DGRIN3BGRIN1
Midafotel SCHEMBL1061150 0.83 ALOX15 (1.00) ALOX15MAPTGRIN2DGRIN3BGRIN1
Midafotel SCHEMBL974897 0.83 ALOX15 (1.00) ALOX15MAPTGRIN2DGRIN3BGRIN1
Midafotel SCHEMBL1061155 0.83 ALOX15 (1.00) ALOX15MAPTGRIN2DGRIN3BGRIN1
SCHEMBL5058496 0.81 ALOX15 (0.80) ALOX15MAPTGRIN2DGRIN3BGRIN1
SCHEMBL5058501 0.80 ALOX15 (0.78) ALOX15MAPTGRIN2DGRIN3BGRIN1
SCHEMBL8828056 0.76 GRIN2D (0.72) ALOX15MAPTGRIN2DGRIN3BGRIN1
SCHEMBL20694120 0.74 ALOX15 (0.68) ALOX15MAPTGRIN2DGRIN3BGRIN1

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 claimed
US-5399693-A Substituted piperazine-2-carboxylic acids and derivatives thereof BRITISH TECHNOLOGY GROUP LIMITED (GB) 1995-03-21 US claimed
EP-0159889-B1 4-SUBSTITUTED PIPERAZINE-2-CARBOXYLIC ACIDS PROCESS AND PHARMACEUTICAL COMPOSITIONS BTG INTERNATIONAL LIMITED (GB) 1992-09-30 EP claimed
US-5399693-A Substituted piperazine-2-carboxylic acids and derivatives thereof BRITISH TECHNOLOGY GROUP LIMITED (GB) 1995-03-21 US disclosed