SCHEMBL11279244

SCHEMBL11279244

O=C(O)CCCCCCCCCCCCCCCCCCCC(O)C(O)CO

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
TSHR P16473 2/20 0.52
NFKB1 P19838 1/20 0.52
PMP22 Q01453 1/20 0.52
FFAR4 Q5NUL3 2/20 0.52
FFAR1 O14842 2/20 0.52
GPR84 Q9NQS5 3/20 0.50
GSTK1 Q9Y2Q3 2/20 0.48
ALDH1A1 P00352 2/20 0.46
ENPEP Q07075 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
MAPT P10636 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PPARG P37231 2/20 0.43
PPARD Q03181 2/20 0.43
PPARA Q07869 2/20 0.43
SLC22A6 Q4U2R8 1/20 0.43

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
SCHEMBL3100157 1.00 LMNA (0.52) LMNATSHRNFKB1PMP22FFAR4
SCHEMBL11283608 1.00 LMNA (0.52) LMNATSHRNFKB1PMP22FFAR4
SCHEMBL10944728 1.00 LMNA (0.52) LMNATSHRNFKB1PMP22FFAR4
Adipic Acid SCHEMBL7050293 1.00 LMNA (0.52) LMNATSHRNFKB1PMP22FFAR4
SCHEMBL15153687 0.98 LMNA (0.50) LMNATSHRNFKB1PMP22FFAR4
SCHEMBL2473072 0.98 LMNA (0.50) LMNATSHRNFKB1PMP22FFAR4
SCHEMBL10618648 0.94 FFAR4 (0.61) LMNATSHRNFKB1PMP22FFAR4
SCHEMBL12355088 0.91 CAMK2A (0.46) LMNATSHRNFKB1PMP22FFAR4
SCHEMBL1244924 0.91 CAMK2A (0.46) LMNATSHRNFKB1PMP22FFAR4
Sebacic Acid SCHEMBL10010951 0.91 TSHR (0.63) LMNATSHRNFKB1PMP22FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0052972-A1 Fabric conditioning article, method of manufacturing same, and method of conditioning clothes therewith BEECHAM INC. (US) 1982-06-02 EP disclosed