SCHEMBL13670914

SCHEMBL13670914

CC(=O)N[C@H](Cc1ccccc1)C(=O)NC(Cc1cc(I)c(O)c(I)c1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 1/20 0.60
CTSS P25774 1/20 0.54
CTSK P43235 1/20 0.54
MME P08473 8/20 0.52
ACE P12821 4/20 0.49
CPA1 P15085 4/20 0.49
ACE2 Q9BYF1 4/20 0.49
PAM P19021 1/20 0.48
TACR1 P25103 1/20 0.47
FPR2 P25090 1/20 0.47

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
SCHEMBL4875012 1.00 GNPAT (0.60) GNPATCTSSCTSKMMEACE
SCHEMBL5175793 1.00 GNPAT (0.60) GNPATCTSSCTSKMMEACE
SCHEMBL468888 0.88 SIRT5 (0.52) GNPAT
SCHEMBL468886 0.88 SIRT5 (0.52) GNPAT
SCHEMBL27817100 0.88 GNPAT (0.73) GNPATCTSSCTSKMMEACE
SCHEMBL1081111 0.88 GNPAT (0.73) GNPATCTSSCTSKMMEACE
SCHEMBL5692056 0.88 GNPAT (0.73) GNPATCTSSCTSKMMEACE
SCHEMBL6677690 0.88 GNPAT (0.73) GNPATCTSSCTSKMMEACE
SCHEMBL5997104 0.84 MME (0.66) GNPATCTSSCTSKMMEACE
SCHEMBL15692299 0.84 MME (0.66) GNPATCTSSCTSKMMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7608465-B2 Multi-analyte diagnostic test for thyroid disorders BIO-RAD LABORATORIES, INC. (US) 2009-10-27 US disclosed
US-7608465-B2 Multi-analyte diagnostic test for thyroid disorders BIO-RAD LABORATORIES, INC. (US) 2009-10-27 US disclosed
US-7271009-B1 Multi-analyte diagnostic test for thyroid disorders BIO-RAD LABORATORIES, INC. (US) 2007-09-18 US disclosed
US-7271009-B1 Multi-analyte diagnostic test for thyroid disorders BIO-RAD LABORATORIES, INC. (US) 2007-09-18 US disclosed
US-20070178604-A1 Multi-analyte diagnostic test for thyroid disorders BIO-RAD LABORATORIES, INC. (US) 2007-08-02 US disclosed
US-20070178604-A1 Multi-analyte diagnostic test for thyroid disorders BIO-RAD LABORATORIES, INC. (US) 2007-08-02 US disclosed