SCHEMBL7913554

SCHEMBL7913554

CC(=O)NC12CCCC3(C)CC(C)(CC3C1)C2

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 10/20 0.33
TSHR P16473 1/20 0.33
HDAC1 Q13547 4/20 0.31
HDAC8 Q9BY41 4/20 0.31
HDAC6 Q9UBN7 4/20 0.31
HDAC3 O15379 3/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL14385281 0.87 EPHX1 (0.30)
SCHEMBL14385370 0.80 TSHR (0.35) EPHX2TSHRHDAC1HDAC8HDAC6
SCHEMBL13699365 0.78 GRIN2D (0.33)
SCHEMBL7921807 0.76 GRIN2D (0.30)
SCHEMBL12858009 0.69 EPHX2 (0.57) EPHX2TSHRHDAC1HDAC8HDAC6
SCHEMBL733617 0.69 EPHX2 (0.62) EPHX2HDAC1HDAC8HDAC6HDAC3
SCHEMBL16118626 0.69 GAA (0.44) EPHX2TSHRHDAC1HDAC8HDAC6
SCHEMBL20082792 0.69 FFAR3 (0.31)
SCHEMBL17133526 0.68 TSHR (0.34) EPHX2TSHRGAA
SCHEMBL4973914 0.67 GAA (0.47) EPHX2TSHRHDAC1HDAC8HDAC6

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
WO-2010083996-A1 A PROCESS FOR PREPARING MEMANTINE MERZ PHARMA GMBH & CO. KGAA (DE) 2010-07-29 WO disclosed
WO-2007132476-A2 A PROCESS FOR THE PREPARATION OF MEMANTINE HYDROCHLORIDE MATRIX LABORATORIES LIMITED (IN) 2007-11-22 WO disclosed