SCHEMBL9980489

SCHEMBL9980489

CCC(=O)OC(=N)CC(O)C(=O)OC(=O)CC

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.35
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
BLM P54132 1/20 0.32
WRN Q14191 1/20 0.32
HIF1A Q16665 1/20 0.32

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
SCHEMBL18048859 0.83 MGAM (0.39)
SCHEMBL4786240 0.82 TRPA1 (0.34) ALDH1A1CYP2C19
SCHEMBL6025638 0.82
SCHEMBL27814945 0.81 NAAA (0.39) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL23355066 0.79 KDM2A (0.33)
SCHEMBL4326668 0.78 ALDH1A1 (0.36) ALDH1A1
SCHEMBL133605 0.77
SCHEMBL4969192 0.77 LMNA (0.37) ALDH1A1
SCHEMBL6767253 0.77 TSHR (0.40)
SCHEMBL1742070 0.76 RECQL (0.38)

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
EP-2773659-A2 FIBRONECTIN BINDING DOMAINS WITH REDUCED IMMUNOGENICITY Bristol-Myers Squibb Company (US) 2014-09-10 EP disclosed
WO-2013067029-A9 FIBRONECTIN BINDING DOMAINS WITH REDUCED IMMUNOGENICITY BRISTOL-MYERS SQUIBB COMPANY (US) 2013-09-06 WO disclosed
WO-2013067029-A2 FIBRONECTIN BINDING DOMAINS WITH REDUCED IMMUNOGENICITY BRISTOL-MYERS SQUIBB COMPANY (US) 2013-05-10 WO disclosed
EP-2576615-A2 FIBRONECTIN BASED SCAFFOLD PROTEINS HAVING IMPROVED STABILITY Bristol-Myers Squibb Pharma Company (US) 2013-04-10 EP disclosed
WO-2011150133-A2 FIBRONECTIN BASED SCAFFOLD PROTEINS HAVING IMPROVED STABILITY BRISTOL-MYERS SQUIBB COMPANY (US) 2011-12-01 WO disclosed