SCHEMBL2579588

SCHEMBL2579588

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

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.56
FOLH1 Q04609 1/20 0.54
NAALAD2 Q9Y3Q0 1/20 0.50
MME P08473 7/20 0.49
ACE2 Q9BYF1 2/20 0.49
CPA1 P15085 1/20 0.49
SLC7A5 Q01650 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
CTSS P25774 1/20 0.45
CTSK P43235 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45

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
SCHEMBL2818149 1.00 ACE (0.56) ACEFOLH1NAALAD2MMEACE2
SCHEMBL8823272 0.87 ACE (0.58) ACEFOLH1NAALAD2MMEACE2
SCHEMBL953389 0.87 FOLH1 (0.56) ACEFOLH1NAALAD2MMEACE2
SCHEMBL8823270 0.87 ACE (0.58) ACEFOLH1NAALAD2MMEACE2
SCHEMBL838885 0.87 FOLH1 (0.56) ACEFOLH1NAALAD2MMEACE2
SCHEMBL27802669 0.85 ACE (0.53) ACEFOLH1NAALAD2MMEACE2
SCHEMBL17393507 0.84 ACE (0.56) ACEFOLH1NAALAD2MMEACE2
SCHEMBL7136038 0.79 FOLH1 (0.51) ACEFOLH1NAALAD2MMEACE2
SCHEMBL1008925 0.78 FOLH1 (0.56) ACEFOLH1NAALAD2MMEACE2
SCHEMBL160418 0.78 FOLH1 (0.60) ACEFOLH1NAALAD2MMEACE2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-8050477-B2 Radiation therapy flanning procedure KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2011-11-01 US disclosed
US-20090028408-A1 RADIATION THERAPY FLANNING PROCEDURE KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2009-01-29 US disclosed
EP-1981593-A2 IMPROVED RADIATION THERAPY PLANNING PROCEDURE Philips Intellectual Property & Standards GmbH (DE) 2008-10-22 EP disclosed
WO-2007088492-A2 IMPROVED RADIATION THERAPY PLANNING PROCEDURE PHILIPS INTELLECTUAL PROPERTY & STANDARDS GMBH (DE) 2007-08-09 WO disclosed