SCHEMBL6300076

SCHEMBL6300076

CC(=O)N(Cl)C(Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.53
ESR1 P03372 3/20 0.46
ESR2 Q92731 3/20 0.46
FOLH1 Q04609 1/20 0.41
TAAR1 Q96RJ0 3/20 0.41
SLC6A2 P23975 1/20 0.41
ADAMTS5 Q9UNA0 1/20 0.39
POLB P06746 1/20 0.39
CA2 P00918 1/20 0.39
CAMK2A Q9UQM7 1/20 0.39
MME P08473 1/20 0.39
ACE P12821 1/20 0.39
NAALAD2 Q9Y3Q0 1/20 0.38

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
SCHEMBL29773601 1.00 SLC7A5 (0.53) SLC7A5ESR1ESR2FOLH1TAAR1
SCHEMBL6300074 1.00 SLC7A5 (0.53) SLC7A5ESR1ESR2FOLH1TAAR1
SCHEMBL11710892 0.87 ADAMTS5 (0.50) SLC7A5FOLH1ADAMTS5POLB
SCHEMBL31114841 0.87 ADAMTS5 (0.50) SLC7A5FOLH1ADAMTS5POLB
SCHEMBL7163410 0.85 SLC7A5 (0.58) SLC7A5ESR1ESR2FOLH1TAAR1
SCHEMBL7163413 0.85 SLC7A5 (0.58) SLC7A5ESR1ESR2FOLH1TAAR1
SCHEMBL607090 0.83 SLC7A5 (0.55) SLC7A5ESR1ESR2FOLH1TAAR1
SCHEMBL607091 0.83 SLC7A5 (0.55) SLC7A5ESR1ESR2FOLH1TAAR1
SCHEMBL7373699 0.82 SLC7A5 (0.54) SLC7A5ESR1ESR2FOLH1TAAR1
SCHEMBL31127604 0.82 SLC7A5 (0.54) SLC7A5ESR1ESR2FOLH1TAAR1

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-101153300-B Method for splitting and producing D-tyrosine-15N by enzymatic method SHANGHAI RES INST CHEMICAL IND 2010-04-07 CN disclosed
CN-101153300-A Method for splitting and producing D-tyrosine-**N by enzymatic method SHANGHAI CHEMICAL ACADEMY (CN) 2008-04-02 CN disclosed
US-6939716-B2 Method for detecting conditions indicative of sepsis WASHINGTON UNIVERSITY (US) 2005-09-06 US disclosed
EP-1427845-A2 METHOD FOR DETECTING SEPSIS Washington University (US) 2004-06-16 EP disclosed
US-20030100122-A1 Method for detecting conditions indicative of sepsis WASHINGTON UNIVERSITY 2003-05-29 US disclosed
WO-2003025212-A2 METHOD FOR DETECTING SEPSIS WASHINGTON UNIVERSITY (US) 2003-03-27 WO disclosed
CN-1033031-C Modified gangliosides and functional derivatives thereof FIDIA SPA (IT) 1996-10-16 CN disclosed
CN-1051912-A Improved gangliosides and functional derivatives thereof FIDIA B P A (IT) 1991-06-05 CN disclosed