SCHEMBL17466176

SCHEMBL17466176

C#CCCCCc1cnc(N)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.42
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
GPR84 Q9NQS5 2/20 0.34
HSP90B1 P14625 2/20 0.32
HRH4 Q9H3N8 2/20 0.32
HRH1 P35367 1/20 0.32
MASP2 O00187 1/20 0.31
MIF P14174 1/20 0.31
HRH3 Q9Y5N1 1/20 0.30

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
SCHEMBL17466177 0.98 AOC3 (0.41) AOC3ALDH1A1CYP3A4ALOX15GPR84
SCHEMBL12598154 0.77 HRH3 (0.50) AOC3HRH4HRH1HRH3
SCHEMBL17466175 0.77
SCHEMBL481044 0.76 GPR84 (0.50) AOC3GPR84HRH3
SCHEMBL14114477 0.76 AOC3 (0.46) AOC3GPR84HRH4HRH1MASP2
SCHEMBL12598153 0.75 AOC3 (0.48) AOC3HRH4HRH1HRH3
SCHEMBL2359802 0.70 FOLR1 (0.53)
SCHEMBL3655766 0.70
SCHEMBL12595083 0.67 MIF (0.35) ALDH1A1CYP3A4ALOX15MIF
SCHEMBL3445980 0.66

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-9422404-B2 2-aminoimidazole-functional silicone compositions and methods of making the same DOW CORNING CORPORATION (US) 2016-08-23 US disclosed
US-20160024257-A1 2-Aminoimidazole-Functional Silicone Compositions And Methods Of Making The Same DOW SILICONES CORPORATION 2016-01-28 US disclosed