SCHEMBL7071095

SCHEMBL7071095

CC(C)(C)Oc1ccc(CC(NC(=O)C(C)(C)CCCCOc2cc(-c3ccc4c(c3)OCO4)cc(-c3ccccc3)n2)C(=O)O)cc1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 18/20 0.67
MME P08473 1/20 0.40
ACE P12821 1/20 0.40

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
SCHEMBL6757483 0.94 LTB4R (0.64) LTB4R
SCHEMBL6759576 0.92 LTB4R (0.69) LTB4RMMEACE
SCHEMBL6757485 0.85 LTB4R (0.51) LTB4R
SCHEMBL7123679 0.85 LTB4R (0.76) LTB4R
SCHEMBL6757772 0.85 LTB4R (0.76) LTB4R
SCHEMBL6759579 0.84 LTB4R (0.56) LTB4RMMEACE
SCHEMBL6760445 0.81 LTB4R (0.63) LTB4R
SCHEMBL6757553 0.81 LTB4R (1.00) LTB4R
SCHEMBL6755968 0.80 LTB4R (0.57) LTB4R
SCHEMBL6756003 0.80 LTB4R (0.69) LTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003099810-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2003-12-04 WO disclosed
EP-0999856-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION Du Pont Pharmaceuticals Company (US) 2000-05-17 EP disclosed
WO-1998015295-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION DUPONT PHARMACEUTICALS COMPANY (US) 1998-04-16 WO disclosed