SCHEMBL16968356

SCHEMBL16968356

CC/C=C\CCCC(O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
CYP19A1 P11511 4/20 0.42
F7 P08709 3/20 0.42
F3 P13726 3/20 0.42
PPARG P37231 3/20 0.42
OXER1 Q8TDS5 3/20 0.42
KMT2A Q03164 3/20 0.42
PTGS1 P23219 2/20 0.42
PPARD Q03181 2/20 0.42
PPARA Q07869 2/20 0.42
ADORA3 P0DMS8 2/20 0.42
RXRA P19793 2/20 0.42
MAPT P10636 3/20 0.39
CYP3A4 P08684 3/20 0.39
NR1I2 O75469 2/20 0.39
PTGS2 P35354 2/20 0.39
FFAR1 O14842 2/20 0.39
MEN1 O00255 2/20 0.39
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 2/20 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
SCHEMBL29813121 0.93 ALDH1A1 (0.42) ALDH1A1CYP19A1F7F3PPARG
SCHEMBL13491390 0.87 ALDH1A1 (0.52) ALDH1A1CYP19A1F7F3PPARG
SCHEMBL31436976 0.85 ALDH1A1 (0.42) ALDH1A1CYP19A1F7F3PPARG
SCHEMBL8527094 0.85 ALDH1A1 (0.55) ALDH1A1CYP19A1F7F3PPARG
SCHEMBL28985210 0.84
SCHEMBL5364544 0.83 ALDH1A1 (0.42) ALDH1A1CYP19A1F7F3PPARG
SCHEMBL6476352 0.83 ALDH1A1 (0.42) ALDH1A1CYP19A1F7F3PPARG
SCHEMBL13703344 0.83 ALDH1A1 (0.42) ALDH1A1CYP19A1F7F3PPARG
SCHEMBL6473375 0.83 ALDH1A1 (0.42) ALDH1A1CYP19A1F7F3PPARG
SCHEMBL6473370 0.83 ALDH1A1 (0.42) ALDH1A1CYP19A1F7F3PPARG

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
US-20150216182-A1 COMPOSITIONS AND METHODS OF THE ATTRACTION AND REPULSION OF INSECTS OLFACTOR LABORATORIES, INC. 2015-08-06 US disclosed