SCHEMBL7211442

SCHEMBL7211442

CCCCCN(C)CCCCCCOC1CCC(N(C)C(=S)Nc2ccc(Cl)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.39
MAPT P10636 3/20 0.39
LSS P48449 3/20 0.38
SMN1; SMN2 Q16637 5/20 0.37
ALDH1A1 P00352 1/20 0.37
PTBP1 P26599 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
CCKBR P32239 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
POLB P06746 2/20 0.35
HTT P42858 1/20 0.35
NPC1 O15118 1/20 0.35
ALOX12 P18054 1/20 0.35
RECQL P46063 1/20 0.35

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
SCHEMBL7211436 1.00 LMNA (0.39) LMNAMAPTLSSSMN1; SMN2ALDH1A1
SCHEMBL7209307 0.89 SMN1; SMN2 (0.47) LMNAMAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL7208602 0.89 LMNA (0.41) LMNAMAPTLSSSMN1; SMN2KDM4E
SCHEMBL7208600 0.89 LMNA (0.41) LMNAMAPTLSSSMN1; SMN2KDM4E
SCHEMBL7205073 0.88 ALDH1A1 (0.46) LMNALSSALDH1A1PTBP1CCKBR
SCHEMBL7205075 0.88 ALDH1A1 (0.46) LMNALSSALDH1A1PTBP1CCKBR
SCHEMBL4803673 0.88 LSS (0.46) LMNAMAPTLSSSMN1; SMN2KDM4E
SCHEMBL7211279 0.88 LMNA (0.37) LMNAMAPTLSSSMN1; SMN2KDM4E
SCHEMBL4803666 0.88 LSS (0.46) LMNAMAPTLSSSMN1; SMN2KDM4E
SCHEMBL7208794 0.85 LMNA (0.42) LMNAMAPTLSSSMN1; SMN2KDM4E

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