SCHEMBL461620

SCHEMBL461620

CCC(CC)(CC)C(=O)NC(C)(C)CO.CCNC(=O)C(CC)(C(C)C)C(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL291784 0.80 MMP1 (0.33)
SCHEMBL291139 0.80 CNR1 (0.36) CNR1CNR2
SCHEMBL300067 0.75 CNR1 (0.32) CNR1CNR2
SCHEMBL27855150 0.73
SCHEMBL2487164 0.72
SCHEMBL14004131 0.69 MMP1 (0.39)
SCHEMBL11344874 0.68 CNR1 (0.35) CNR1CNR2
SCHEMBL31183070 0.67 MMP1 (0.38)
SCHEMBL618600 0.66 EPHX1 (0.44) CNR1CNR2
SCHEMBL27097050 0.66 RIPK1 (0.39) CNR1CNR2

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
US-20130216648-A1 CHEWING GUM COMPOSITIONS PROVIDING FLAVOR RELEASE PROFILES KRAFT FOODS GLOBAL BRANDS LLC (US) 2013-08-22 US disclosed
EP-2613649-A1 CHEWING GUM COMPOSITIONS PROVIDING FLAVOR RELEASE PROFILES Kraft Foods Global Brands LLC (US) 2013-07-17 EP disclosed
WO-2012034012-A1 CHEWING GUM COMPOSITIONS PROVIDING FLAVOR RELEASE PROFILES KRAFT FOODS GLOBAL BRANDS LLC (US) 2012-03-15 WO disclosed