SCHEMBL20183497

SCHEMBL20183497

CCCCC(=O)N(Cc1ccc(-c2ccccc2)cc1[N+](=O)[O-])c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 20/20 0.58
AGTR1 P30556 1/20 0.49

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
SCHEMBL20183846 0.81 LTB4R2 (0.70) LTB4R2AGTR1
SCHEMBL14706246 0.77 LTB4R2 (0.87) LTB4R2AGTR1
SCHEMBL28545854 0.74 CRHBP (0.51)
SCHEMBL16284347 0.74 CRHBP (0.54)
SCHEMBL20183488 0.74 LTB4R2 (0.66) LTB4R2AGTR1
SCHEMBL20183566 0.73 LTB4R2 (0.76) LTB4R2AGTR1
SCHEMBL14691608 0.73 LTB4R2 (1.00) LTB4R2AGTR1
SCHEMBL18425213 0.72 LTB4R2 (1.00) LTB4R2AGTR1
SCHEMBL20183761 0.72 LTB4R2 (0.71) LTB4R2
SCHEMBL14691637 0.71 LTB4R2 (1.00) LTB4R2AGTR1

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
EP-3327001-A1 NOVEL COMPOUND HAVING BLT INHIBITORY ACTIVITY AND COMPOSITION, FOR PREVENTING OR TREATING INFLAMMATORY DISEASES, COMPRISING SAME AS ACTIVE INGREDIENT Dongguk University Industry-Academic Cooperation Foundation (KR) 2018-05-30 EP disclosed