SCHEMBL7534573

SCHEMBL7534573

CCCCOC(=O)NCCCC[C@@H](N)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.57
DPP7 Q9UHL4 1/20 0.50
EPHX2 P34913 2/20 0.48
GNAI3 P08754 1/20 0.48
GNAO1 P09471 1/20 0.48
GNAI1 P63096 1/20 0.48

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
SCHEMBL457464 1.00 ACHE (0.57) ACHEDPP7EPHX2GNAI3GNAO1
SCHEMBL7804987 0.94 ACHE (0.62) ACHEDPP7EPHX2GNAI3GNAO1
SCHEMBL7803301 0.94 ACHE (0.62) ACHEDPP7EPHX2GNAI3GNAO1
SCHEMBL7804961 0.94 ACHE (0.62) ACHEDPP7EPHX2GNAI3GNAO1
SCHEMBL7797292 0.94 ACHE (0.62) ACHEDPP7EPHX2GNAI3GNAO1
SCHEMBL9061677 0.90 ACHE (0.64) ACHEEPHX2
SCHEMBL16053917 0.90 ACHE (0.56) ACHEDPP7EPHX2GNAI3GNAO1
SCHEMBL16054345 0.90 ACHE (0.56) ACHEDPP7EPHX2GNAI3GNAO1
SCHEMBL17852152 0.88 ACHE (0.54) ACHEDPP7
SCHEMBL20192789 0.87 GSR (0.56) ACHEDPP7GNAI3GNAO1GNAI1

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-2002028814-A2 NMDA RECEPTOR CHANNEL BLOCKER WITH NEUROPROTECTIVE ACTIVITY REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2002-04-11 WO disclosed