SCHEMBL6409113

SCHEMBL6409113

C=C/C=C/C=C/CCCCC(O)CCC

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.40
GPR132 Q9UNW8 1/20 0.40
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.39
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
MAPT P10636 1/20 0.37
FASN P49327 1/20 0.35
FAAH O00519 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP3A4 P08684 1/20 0.34
PTGS1 P23219 1/20 0.33
OPRK1 P41145 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33

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
SCHEMBL6409116 1.00 PPARG (0.40) PPARGGPR132ALDH1A1TSHRFFAR1
SCHEMBL6409120 1.00 PPARG (0.40) PPARGGPR132ALDH1A1TSHRFFAR1
SCHEMBL6130440 1.00 PPARG (0.40) PPARGGPR132ALDH1A1TSHRFFAR1
SCHEMBL7799168 0.98 PPARG (0.42) PPARGGPR132ALDH1A1TSHRFFAR1
SCHEMBL7171969 0.98 PPARG (0.42) PPARGGPR132ALDH1A1TSHRFFAR1
SCHEMBL7799171 0.98 PPARG (0.42) PPARGGPR132ALDH1A1TSHRFFAR1
SCHEMBL7171967 0.98 PPARG (0.42) PPARGGPR132ALDH1A1TSHRFFAR1
SCHEMBL7171974 0.98 PPARG (0.42) PPARGGPR132ALDH1A1TSHRFFAR1
SCHEMBL8332550 0.93 FFAR1 (0.40) PPARGGPR132ALDH1A1TSHRFFAR1
SCHEMBL8332552 0.93 FFAR1 (0.40) PPARGGPR132ALDH1A1TSHRFFAR1

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
US-20050059090-A1 Method of screening non-peptide, non-steroid invertebrate pheromone compounds having mitogen-activated protein kinase modulating activity and compositions containing the same ZAMIR NADAV (IL) 2005-03-17 US claimed
US-6806293-B1 SREENING FOR MITOGEN ACTIVATED PROTEIN (MAP) INTERACTION DARLEY PHARMACEUTICALS LTD (IL) 2004-10-19 US claimed
US-20050059090-A1 Method of screening non-peptide, non-steroid invertebrate pheromone compounds having mitogen-activated protein kinase modulating activity and compositions containing the same ZAMIR NADAV (IL) 2005-03-17 US disclosed
US-6806293-B1 SREENING FOR MITOGEN ACTIVATED PROTEIN (MAP) INTERACTION DARLEY PHARMACEUTICALS LTD (IL) 2004-10-19 US disclosed