SCHEMBL27543988

SCHEMBL27543988

NC(CC=O)C(=O)OC(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC1A1 P43005 4/20 0.44
▸ SLC1A3 P43003 3/20 0.44
▸ SLC1A2 P43004 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ HCAR2 Q8TDS4 1/20 0.43
▸ MAPK1 P28482 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ SLC6A2 P23975 1/20 0.42
▸ SLC6A3 Q01959 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ SLC15A1 P46059 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ TSHR P16473 1/20 0.40
▸ ALPI P09923 1/20 0.40

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
SCHEMBL27426825 0.88 SLC1A1 (0.49) SLC1A1SLC1A3SLC1A2KMT2AMEN1
SCHEMBL20349700 0.88 SLC1A1 (0.49) SLC1A1SLC1A3SLC1A2KMT2AMEN1
SCHEMBL3985411 0.83 SLC7A5 (0.56) SLC1A1SLC1A3SLC1A2KMT2AALDH1A1
SCHEMBL19331556 0.83 ALDH1A1 (0.47) SLC1A1SLC1A3SLC1A2KMT2AMEN1
SCHEMBL7272552 0.83 ALDH1A1 (0.47) SLC1A1SLC1A3SLC1A2KMT2AMEN1
SCHEMBL383649 0.83 ALDH1A1 (0.47) SLC1A1SLC1A3SLC1A2KMT2AMEN1
Hydrochloric Acid SCHEMBL382326 0.82 ALDH1A1 (0.46) SLC1A1SLC1A3SLC1A2KMT2AMEN1
SCHEMBL27794910 0.82 ALDH1A1 (0.50) SLC1A1SLC1A3SLC1A2KMT2AMEN1
SCHEMBL6874313 0.81 SLC15A1 (0.49) SLC1A1SLC1A3SLC1A2KMT2AMEN1
SCHEMBL27677759 0.80 ALDH1A1 (0.50) SLC1A1SLC1A3SLC1A2KMT2AMEN1

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-101505784-B Cyclic natriuretic peptide constructs PALATIN TECHNOLOGIES INC 2013-08-21 — — CN disclosed
CN-101505784-A Cyclic natriuretic peptide constructs PALATIN TECHNOLOGIES INC (US) 2009-08-12 — — CN disclosed
CN-101484171-A Amino acid surrogates for peptidic constructs PALATIN TECHNOLOGIES INC (US) 2009-07-15 — — CN disclosed
CN-1525978-A C-terminal modified oxamyl dipeptides as inhibitors of the ICE/ced-3 family of cysteine proteases 伊邓药品公司 2004-09-01 — — CN disclosed
CN-1313846-A C-terminal modified oxamyl dipeptides as inhibitors of the ICE/ced-3 family of cystenine proteases IDUN PHARMACEUTICALS INC (US) 2001-09-19 — — CN disclosed
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