SCHEMBL7209246

SCHEMBL7209246

CCCCCN(C)CCCCCCOC1CCC(N(C)C(=O)c2ccc(C(C)=O)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LSS P48449 6/20 0.45
MAOB P27338 4/20 0.42
MCHR1 Q99705 2/20 0.38
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
GAA P10253 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL7209249 1.00 LSS (0.45) LSSMAOBMCHR1THRATHRB
SCHEMBL7212791 0.92 LSS (0.45) LSSMCHR1THRATHRBNPC1
SCHEMBL7212794 0.92 LSS (0.45) LSSMCHR1THRATHRBNPC1
SCHEMBL7208952 0.91 LSS (0.44) LSSMCHR1THRATHRBGAA
SCHEMBL7204624 0.91 LSS (0.56) LSSMCHR1THRATHRB
SCHEMBL7204630 0.91 LSS (0.56) LSSMCHR1THRATHRB
SCHEMBL7204881 0.91 LSS (0.56) LSSMCHR1THRATHRB
SCHEMBL7208948 0.91 LSS (0.44) LSSMCHR1THRATHRBGAA
SCHEMBL7212170 0.91 LSS (0.48) LSSMCHR1THRATHRB
SCHEMBL7204876 0.91 LSS (0.56) LSSMCHR1THRATHRB

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-1311475-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-05-21 EP disclosed
WO-2002014267-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-02-21 WO disclosed