SCHEMBL7533694

SCHEMBL7533694

CCCCCCCCCCCCCCCO.CCOS(=O)(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
ALDH1A1 P00352 2/20 0.54
TSHR P16473 2/20 0.54
HSD17B10 Q99714 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.50
CA1 P00915 10/20 0.41
CA2 P00918 10/20 0.41
CA9 Q16790 7/20 0.41
CA12 O43570 3/20 0.41
CA7 P43166 3/20 0.41
CA14 Q9ULX7 3/20 0.41
CA3 P07451 2/20 0.41
CA4 P22748 2/20 0.41
CA6 P23280 2/20 0.41
CA5A P35218 2/20 0.41
CA5B Q9Y2D0 2/20 0.41
RECQL P46063 2/20 0.39
GLA P06280 1/20 0.39

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
Cetyl Alcohol SCHEMBL14784343 1.00 LMNA (0.54) LMNAALDH1A1TSHRHSD17B10MEN1
Myristyl Alcohol SCHEMBL14784354 1.00 LMNA (0.54) LMNAALDH1A1TSHRHSD17B10MEN1
Cetostearyl Alcohol SCHEMBL14785056 1.00 LMNA (0.54) LMNAALDH1A1TSHRHSD17B10MEN1
Undecane SCHEMBL28633727 0.91 CA1 (0.46) TSHRCA1CA2CA9CA12
Dodecane SCHEMBL28621410 0.91 CA1 (0.46) TSHRCA1CA2CA9CA12
Octane SCHEMBL28616568 0.91 CA1 (0.46) TSHRCA1CA2CA9CA12
Dodecane SCHEMBL27634325 0.89 CA1 (0.45) TSHRCA1CA2CA9CA12
Tetradecane SCHEMBL27615105 0.89 CA1 (0.45) TSHRCA1CA2CA9CA12
Hexadecane SCHEMBL27834981 0.89 CA1 (0.45) TSHRCA1CA2CA9CA12
Water SCHEMBL27852899 0.89 CA1 (0.45) TSHRCA1CA2CA9CA12

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-1196526-A1 DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2002-04-17 EP disclosed
WO-2001007553-A1 DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-02-01 WO disclosed