SCHEMBL15058882

SCHEMBL15058882

[CH2]C([CH2])([CH2])CCCCCCCC(O)CCCCCCCCCCC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.59
FFAR1 O14842 2/20 0.59
ACACB O00763 1/20 0.50
ACACA Q13085 1/20 0.50
LMNA P02545 2/20 0.44
TSHR P16473 1/20 0.44
NFKB1 P19838 1/20 0.44
PMP22 Q01453 1/20 0.44
GSTK1 Q9Y2Q3 2/20 0.43
PTPN1 P18031 1/20 0.42
FAAH O00519 1/20 0.41
TBXA2R P21731 1/20 0.41
PTGFR P43088 1/20 0.41
PTGER2 P43116 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL15058968 0.89 FFAR4 (0.59) FFAR4FFAR1ACACBACACALMNA
SCHEMBL15057590 0.86 TSHR (0.60) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL18419647 0.86 TSHR (0.60) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL15058597 0.86 TSHR (0.60) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL418028 0.86 TSHR (0.60) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL758780 0.86 TSHR (0.60) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL15361928 0.86 TSHR (0.60) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL2862133 0.84 TSHR (0.57) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL15009701 0.84 FFAR4 (0.79) FFAR4FFAR1LMNATSHRNFKB1
SCHEMBL2181858 0.84 FFAR4 (0.79) FFAR4FFAR1LMNATSHRNFKB1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2827829-B1 PEG-FREE ANTIPERSPIRANT OIL-IN-WATER EMULSIONS HAVING IMPROVED FEEL HENKEL AG & CO KGAA (DE) 2017-02-08 EP disclosed
EP-2827829-A2 PEG-FREE ANTIPERSPIRANT OIL-IN-WATER EMULSIONS HAVING IMPROVED FEEL Henkel AG & Co. KGaA (DE) 2015-01-28 EP disclosed
WO-2013092186-A2 PEG-FREE ANTIPERSPIRANT OIL-IN-WATER EMULSIONS HAVING IMPROVED FEEL HENKEL AG & CO. KGAA (DE) 2013-06-27 WO disclosed