SCHEMBL1323910

SCHEMBL1323910

CCCC(CCCC/C=C\CCCCCCC1(C(=O)O)CCO1)CC(O)CO

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
DGKA P23743 1/20 0.36
FAAH O00519 4/20 0.33
CETP P11597 2/20 0.32
TOP1 P11387 2/20 0.32
DEGS1 O15121 1/20 0.32
SPTLC1 O15269 1/20 0.31
SPTLC2 O15270 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31
PPARG P37231 1/20 0.31

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
SCHEMBL1325116 0.93 LMNA (0.32) FFAR1FFAR4
SCHEMBL8520314 0.92 FFAR1 (0.41) FFAR1FFAR4DGKAFAAHSPTLC1
SCHEMBL8520442 0.89 LMNA (0.38) FFAR1FFAR4CETPTP53CYP1A2
SCHEMBL8667713 0.89 LMNA (0.38) FFAR1FFAR4CETPTP53CYP1A2
SCHEMBL8469411 0.84 LMNA (0.38) FFAR1FFAR4CETPTP53CYP1A2
SCHEMBL10974057 0.80 FFAR1 (0.60) FFAR1FFAR4FAAHTOP1CYP1A2
SCHEMBL5342603 0.80 TERT (0.47) FAAHTOP1CYP1A2MAPTCYP2C9
SCHEMBL8519329 0.77 ACACB (0.34) FFAR1FFAR4
SCHEMBL7268157 0.76 FFAR1 (0.43) FFAR1FFAR4DGKAFAAHTOP1
SCHEMBL15392560 0.74 FFAR1 (0.50) FFAR1FFAR4FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011139265-A2 METHOD OF TREATING HAIR MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2011-11-10 WO disclosed
US-20110268681-A1 METHOD OF TREATING HAIR MOMENTIVE PERFORMANCE MATERIALS INC. 2011-11-03 US disclosed
EP-1827370-A1 HAIR PROCESSING AGENT AND METHOD FOR PERMANENT WAVING HAIR Showa Denko K.K. (JP) 2007-09-05 EP disclosed
WO-2006068276-A1 HAIR PROCESSING AGENT AND METHOD FOR PERMANENT WAVING HAIR SHOWA DENKO K.K. (JP) 2006-06-29 WO disclosed