SCHEMBL27596040

SCHEMBL27596040

C=CCN(C)CCCCC1CCC(CNC(=O)Oc2ccc(Cl)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LSS P48449 16/20 0.56
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 1/20 0.36
ADAMTS4 O75173 1/20 0.36
MMP8 P22894 1/20 0.36
ADAMTS5 Q9UNA0 1/20 0.36

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
SCHEMBL27578308 0.90 LSS (0.56) LSS
SCHEMBL28749500 0.89 LSS (0.47) LSS
SCHEMBL6018376 0.84 LSS (0.63) LSS
SCHEMBL6018372 0.84 LSS (0.63) LSS
SCHEMBL4804669 0.83 LSS (0.79) LSS
SCHEMBL4804673 0.83 LSS (0.79) LSS
SCHEMBL4800609 0.82 LSS (0.81) LSS
SCHEMBL4800600 0.82 LSS (0.81) LSS
SCHEMBL6018603 0.82 LSS (0.60) LSSLMNA
SCHEMBL6018604 0.82 LSS (0.60) LSSLMNA

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
CN-1468214-A Novel derivatives of aminocyclohexane - 2004-01-14 CN claimed
CN-1468214-A Novel derivatives of aminocyclohexane - 2004-01-14 CN disclosed