SCHEMBL3849131

SCHEMBL3849131

N#CC1(O)CCCN(C(=O)O)C1Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 9/20 0.41
DPP7 Q9UHL4 3/20 0.39
DPP8 Q6V1X1 2/20 0.39
DPP9 Q86TI2 1/20 0.39
PREP P48147 5/20 0.38
ALDH1A1 P00352 2/20 0.38
PKM P14618 1/20 0.38
ABHD6 Q9BV23 1/20 0.38
DAGLA Q9Y4D2 1/20 0.38
TSHR P16473 1/20 0.37

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
SCHEMBL23458984 0.75 ALDH1A1 (0.42) ALDH1A1
SCHEMBL23458987 0.75 ALDH1A1 (0.42) ALDH1A1
SCHEMBL28485250 0.72 ALDH1A1 (0.42) ALDH1A1
SCHEMBL908981 0.67 SCD5 (0.57) DPP4ABHD6DAGLA
SCHEMBL23459127 0.67 SCD5 (0.57) DPP4ABHD6DAGLA
SCHEMBL27168378 0.67 FAAH (0.37) ALDH1A1ABHD6DAGLATSHR
SCHEMBL27168346 0.67 AOC3 (0.38) ALDH1A1ABHD6DAGLATSHR
SCHEMBL4964339 0.66 HSD11B1 (0.61) DPP4ABHD6DAGLA
SCHEMBL4629395 0.66 HSD11B1 (0.61) DPP4ABHD6DAGLA
SCHEMBL27168362 0.65 FAAH (0.35) ALDH1A1ABHD6DAGLATSHR

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
EP-2102180-A1 SUBSTITUTED AMINOFURANONES AND THEIR USE Bayer Schering Pharma Aktiengesellschaft (DE) 2009-09-23 EP disclosed
WO-2008071359-A1 SUBSTITUTED AMINOFURANONES AND THEIR USE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-06-19 WO disclosed