SCHEMBL8080137

SCHEMBL8080137

COc1ccc(C=CCCCCCC(=O)O)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 3/20 0.69
LTB4R2 Q9NPC1 3/20 0.69
PPARA Q07869 2/20 0.62
FFAR1 O14842 1/20 0.62
PPARG P37231 1/20 0.62
PPARD Q03181 1/20 0.62
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
DRD3 P35462 1/20 0.53
THRB P10828 1/20 0.51
ATM Q13315 1/20 0.51
PDE4B Q07343 1/20 0.51
TBXAS1 P24557 2/20 0.51
CNR1 P21554 2/20 0.50
GSK3B P49841 1/20 0.50
ALB P02768 1/20 0.50
F3 P13726 1/20 0.49
HDAC1 Q13547 1/20 0.47
GRIK1 P39086 1/20 0.47
GRIK2 Q13002 1/20 0.47

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
SCHEMBL1005789 1.00 LTB4R (0.69) LTB4RLTB4R2PPARAFFAR1PPARG
SCHEMBL1005790 1.00 LTB4R (0.69) LTB4RLTB4R2PPARAFFAR1PPARG
SCHEMBL8080134 1.00 LTB4R (0.69) LTB4RLTB4R2PPARAFFAR1PPARG
SCHEMBL8003031 0.98 LTB4R (0.70) LTB4RLTB4R2PPARAFFAR1PPARG
SCHEMBL7999191 0.94 LTB4R (0.65) LTB4RLTB4R2PPARAFFAR1PPARG
SCHEMBL8862104 0.94 LTB4R (0.65) LTB4RLTB4R2PPARAFFAR1PPARG
SCHEMBL16710517 0.88 NPC1 (0.65) LTB4RLTB4R2PPARAFFAR1PPARG
SCHEMBL1005998 0.87 LTB4R (0.55) LTB4RLTB4R2PPARAFFAR1PPARG
SCHEMBL1005999 0.87 LTB4R (0.55) LTB4RLTB4R2PPARAFFAR1PPARG
SCHEMBL1008121 0.85 ALDH1A1 (0.56) LTB4RLTB4R2PPARAFFAR1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6048989-A PARASITICIDES AND ANTIBROTOZOA AGENTS WASHINGTON UNIVERSITY (US) 2000-04-11 US disclosed
US-6025511-A A MYRISTIC ACID SELECTED ANALOGS FOR INHIBITING THE BIOSYNTHESIS OF THE GLYCOSYL PHOSPHATIDYLINOSITOL (GPI) ANCHOR OF THE PARASITE WASHINGTON UNIVERSITY (US) 2000-02-15 US disclosed
US-6001869-A CONTACTING THE PARASITE WITH 2-THIENYL-UNDECENOIC ACID/10-/ WASHINGTON UNIVERSITY (US) 1999-12-14 US disclosed
US-5998642-A Thienyl-containing fatty acid glycosyl phosphatidylinosital analogues used for inhibiting parasitic activity WASHINGTON UNIVERSITY (US) 1999-12-07 US disclosed
US-5760259-A MYRISTIC ACID DERIVATIVES CAPABLE OF INHIBITING BIOSYNTHESIS OF PARASITE'S ANCHORING GROUP WASHINGTON UNIVERSITY (US) 1998-06-02 US disclosed
US-5747537-A Method of inhibiting parasitic activity WASHINGTON UNIVERSITY (US) 1998-05-05 US disclosed