SCHEMBL20726

SCHEMBL20726

[2H]C(F)NC(Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.51
NAALAD2 Q9Y3Q0 1/20 0.51
ACE P12821 6/20 0.50
SLC7A5 Q01650 1/20 0.49
MME P08473 6/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
CPA1 P15085 1/20 0.47
ACE2 Q9BYF1 1/20 0.47
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
ALB P02768 1/20 0.43
IL2 P60568 1/20 0.43

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
SCHEMBL1081372 0.87 FOLH1 (0.54) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL31533362 0.87 FOLH1 (0.54) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL31533361 0.87 FOLH1 (0.54) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL1081373 0.87 FOLH1 (0.54) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL23704504 0.84 FOLH1 (0.51) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL29746410 0.84 FOLH1 (0.51) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL246177 0.84 FOLH1 (0.51) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL10778599 0.81 FOLH1 (0.55) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL8414223 0.81 FOLH1 (0.55) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL2214358 0.81 FOLH1 (0.55) FOLH1NAALAD2ACESLC7A5MME

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
WO-2012025464-A1 FLUORODEUTERIOMETHYL TYROSINE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-01 WO disclosed