SCHEMBL3405980

SCHEMBL3405980

C=C/C=C\C=C\C/C=C\CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.39
OXER1 Q8TDS5 5/20 0.39
ALDH1A1 P00352 5/20 0.35
CYP19A1 P11511 4/20 0.35
PPARG P37231 3/20 0.35
MAPT P10636 3/20 0.35
RXRA P19793 2/20 0.35
FFAR1 O14842 2/20 0.35
F7 P08709 3/20 0.33
F3 P13726 3/20 0.33
PTGS1 P23219 2/20 0.33
KMT2A Q03164 2/20 0.33
PPARD Q03181 2/20 0.33
ADORA3 P0DMS8 1/20 0.33
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
NR1I2 O75469 1/20 0.31
LMNA P02545 1/20 0.31
PLA2G1B P04054 1/20 0.31
CYP3A4 P08684 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
SCHEMBL2864809 1.00 PPARA (0.39) PPARAOXER1ALDH1A1CYP19A1PPARG
SCHEMBL3408450 1.00 PPARA (0.39) PPARAOXER1ALDH1A1CYP19A1PPARG
SCHEMBL3409429 1.00 PPARA (0.39) PPARAOXER1ALDH1A1CYP19A1PPARG
SCHEMBL3405093 1.00 PPARA (0.39) PPARAOXER1ALDH1A1CYP19A1PPARG
SCHEMBL2864812 1.00 PPARA (0.39) PPARAOXER1ALDH1A1CYP19A1PPARG
SCHEMBL3407707 1.00 PPARA (0.39) PPARAOXER1ALDH1A1CYP19A1PPARG
SCHEMBL3405091 1.00 PPARA (0.39) PPARAOXER1ALDH1A1CYP19A1PPARG
SCHEMBL3410187 1.00 PPARA (0.39) PPARAOXER1ALDH1A1CYP19A1PPARG
SCHEMBL1113852 0.90
SCHEMBL23081957 0.84 TRPA1 (0.43) TRPA1

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
US-7749551-B2 Mint composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2010-07-06 US disclosed
US-20070218178-A1 MINT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-09-20 US disclosed