SCHEMBL9847993

SCHEMBL9847993

O=C(O)C(Cc1ccc(O)cc1)NC(F)F

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.54
NAALAD2 Q9Y3Q0 1/20 0.54
ACE P12821 6/20 0.52
SLC7A5 Q01650 1/20 0.51
MME P08473 7/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
CPA1 P15085 1/20 0.49
ACE2 Q9BYF1 1/20 0.49
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
ALB P02768 1/20 0.44
IL2 P60568 1/20 0.44

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
SCHEMBL9847998 1.00 FOLH1 (0.54) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL246178 0.87 FOLH1 (0.58) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL6769407 0.87 FOLH1 (0.51) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL4101776 0.87 FOLH1 (0.58) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL3506385 0.86 MME (0.58) FOLH1NAALAD2ACEMMEL3MBTL1
SCHEMBL3506387 0.86 MME (0.58) FOLH1NAALAD2ACEMMEL3MBTL1
SCHEMBL740392 0.85 L3MBTL1 (0.52) FOLH1MMEMEN1KMT2AL3MBTL1
SCHEMBL3983123 0.84 FOLH1 (0.59) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL3983134 0.84 FOLH1 (0.59) FOLH1NAALAD2ACESLC7A5MME
SCHEMBL27973852 0.84 ACE (0.54) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101768208-B Novel 18F-labelled polypeptide, preparation method and application thereof in tumor imaging UNIV BEIJING NORMAL 2013-06-05 CN disclosed
CN-101723850-B Novel 18F labeled aromatic amino acids, preparation method and application thereof in tumor imaging UNIV BEIJING NORMAL 2012-11-21 CN disclosed
CN-101723849-B Novel 18F labeled amino acid derivatives, preparation method and application thereof in tumor imaging UNIV BEIJING NORMAL 2012-11-21 CN disclosed
CN-101768208-A Novel 18F-labelled polypeptide, preparation method and application thereof in tumor imaging UNIV BEIJING NORMAL 2010-07-07 CN disclosed
CN-101723849-A Novel 18F labeled amino acid derivatives, preparation method and application thereof in tumor imaging UNIV BEIJING NORMAL 2010-06-09 CN disclosed
CN-101723850-A Novel 18F labeled aromatic amino acids, preparation method and application thereof in tumor imaging UNIV BEIJING NORMAL 2010-06-09 CN disclosed
EP-0451422-A1 Pharmaceutically active fluoromethyltyrosine compounds MERRELL DOW PHARMACEUTICALS INC. (US) 1991-10-16 EP disclosed
EP-0451422-A1 Pharmaceutically active fluoromethyltyrosine compounds MERRELL DOW PHARMACEUTICALS INC. (US) 1991-10-16 EP disclosed