SCHEMBL28216930

SCHEMBL28216930

O=C(O)C(Cc1ccc(O)cc1)NOCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.56
ACE P12821 7/20 0.52
FOLH1 Q04609 1/20 0.49
NAALAD2 Q9Y3Q0 1/20 0.49
ECE1 P42892 1/20 0.47
PPARG P37231 2/20 0.47

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
SCHEMBL29664067 1.00 MME (0.56) MMEACEFOLH1NAALAD2ECE1
SCHEMBL6130478 0.94 MME (0.51) MMENAALAD2PPARG
SCHEMBL6130477 0.94 MME (0.51) MMENAALAD2PPARG
SCHEMBL7211707 0.94 MME (0.51) MMENAALAD2PPARG
SCHEMBL11023405 0.86 PPARG (0.52) MMEACEPPARG
SCHEMBL11036427 0.85 BACE1 (0.52) MMEPPARG
SCHEMBL11023403 0.84 MME (0.46) MMEACEFOLH1NAALAD2PPARG
SCHEMBL475961 0.83 FOLH1 (0.54) MMEACEFOLH1NAALAD2
SCHEMBL475962 0.83 FOLH1 (0.54) MMEACEFOLH1NAALAD2
SCHEMBL29491194 0.82 MME (0.62) MMEACEFOLH1NAALAD2

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
CN-108025574-A Thermal recording medium 三光株式会社 2018-05-11 CN disclosed