SCHEMBL27775469

SCHEMBL27775469

C=CCON[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.48
NAALAD2 Q9Y3Q0 1/20 0.48
SLC7A5 Q01650 1/20 0.45
MME P08473 5/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ACE P12821 7/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40

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
SCHEMBL27775468 1.00 FOLH1 (0.48) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL28402498 0.88 MME (0.48) FOLH1NAALAD2MMEL3MBTL1
SCHEMBL28402499 0.88 MME (0.48) FOLH1NAALAD2MMEL3MBTL1
SCHEMBL475961 0.82 FOLH1 (0.54) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL475962 0.82 FOLH1 (0.54) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL3919350 0.82 ALDH1A1 (0.52) FOLH1NAALAD2MMEACECPA1
SCHEMBL6022077 0.82 ALDH1A1 (0.52) FOLH1NAALAD2MMEACECPA1
SCHEMBL10887038 0.82 ALDH1A1 (0.52) FOLH1NAALAD2MMEACECPA1
SCHEMBL476061 0.81 FOLH1 (0.56) FOLH1NAALAD2SLC7A5MMEMEN1
SCHEMBL476060 0.81 FOLH1 (0.56) FOLH1NAALAD2SLC7A5MMEMEN1

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-101522710-A CD4 mimic peptides and their uses COMMISSARIAT ENERGIE ATOMIQUE (FR) 2009-09-02 CN disclosed