SCHEMBL6677358

SCHEMBL6677358

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCC)(CCNCCO)NCCO

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
ALDH1A1 P00352 2/20 0.37
TSHR P16473 2/20 0.37
KMT2A Q03164 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.37
S1PR2 O95136 5/20 0.33
S1PR4 O95977 5/20 0.33
S1PR1 P21453 5/20 0.33
S1PR3 Q99500 5/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NAAA Q02083 1/20 0.33
S1PR5 Q9H228 1/20 0.33
GGPS1 O95749 3/20 0.32
FDPS P14324 4/20 0.32

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
SCHEMBL8368880 0.93 ALDH1A1 (0.46) LMNAALDH1A1TSHRKMT2AHSD17B10
SCHEMBL515592 0.83 LMNA (0.41) LMNAALDH1A1TSHRKMT2AHSD17B10
SCHEMBL115537 0.83 LMNA (0.41) LMNAALDH1A1TSHRKMT2AHSD17B10
SCHEMBL7717007 0.83 LMNA (0.41) LMNAALDH1A1TSHRKMT2AHSD17B10
SCHEMBL474330 0.81 SMN1; SMN2 (0.39) LMNAALDH1A1TSHRKMT2AHSD17B10
Dodecane SCHEMBL27291980 0.78 ALDH1A1 (0.58) LMNAALDH1A1TSHRKMT2AHSD17B10
Undecane SCHEMBL27662246 0.78 ALDH1A1 (0.58) LMNAALDH1A1TSHRKMT2AHSD17B10
Hexadecane SCHEMBL29067562 0.78 ALDH1A1 (0.58) LMNAALDH1A1TSHRKMT2AHSD17B10
SCHEMBL19616490 0.77 TSHR (0.54) ALDH1A1TSHRS1PR2S1PR4S1PR1
Diethanolamine SCHEMBL29041048 0.76 TSHR (0.61) LMNAALDH1A1TSHRKMT2AHSD17B10

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-2004033665-A2 HETEROLOGOUS PLASMA COCKTAIL FOR HIV TREATMENT IMUTEX PHARMACEUTICALS, INC. (US) 2004-04-22 WO disclosed
WO-1995004827-A1 TICK ANTIGEN BIOTECH AUSTRALIA PTY. LTD. (AU) 1995-02-16 WO disclosed