SCHEMBL5848754

SCHEMBL5848754

N[C@H](C1CCCC1)[C@H](O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 11/20 0.50
METAP1 P53582 3/20 0.50
EPHX1 P07099 2/20 0.41
DPP4 P27487 3/20 0.40
TSHR P16473 1/20 0.39
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
ALDH1A1 P00352 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
SCHEMBL5849705 0.98 METAP2 (0.53) METAP2METAP1EPHX1DPP4SLC1A3
SCHEMBL5850001 0.98 METAP2 (0.53) METAP2METAP1EPHX1DPP4SLC1A3
SCHEMBL24520309 0.77 SLC1A3 (0.50) METAP2METAP1EPHX1DPP4SLC1A3
SCHEMBL8282987 0.77 EPHX1 (0.46) METAP2METAP1EPHX1DPP4
SCHEMBL2712392 0.76 DPP4 (0.41) METAP2METAP1EPHX1DPP4SLC1A3
SCHEMBL21563502 0.74 EPHX1 (0.43) METAP2METAP1EPHX1DPP4SLC1A3
SCHEMBL623280 0.73 DPP4 (0.53) EPHX1DPP4SLC1A2SLC1A1
SCHEMBL919635 0.73 DPP4 (0.53) EPHX1DPP4SLC1A2SLC1A1
SCHEMBL1053865 0.73 DPP4 (0.53) EPHX1DPP4SLC1A2SLC1A1
SCHEMBL6257766 0.73 TSHR (0.39) METAP2METAP1EPHX1DPP4TSHR

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
US-20040122098-A1 3-Amino-2-hydroxyalkanoic acids and their prodrugs ABBVIE INC. 2004-06-24 US claimed
US-7030262-B2 3-Amino-2-hydroxyalkanoic acids and their prodrugs ABBOTT LABORATORIES (US) 2006-04-18 US disclosed
EP-1546087-A1 3-AMINO-2-HRYDROXYALKANOIC ACIDS AND THEIR PRODRUGS Abbott Laboratories (US) 2005-06-29 EP disclosed
US-20040122098-A1 3-Amino-2-hydroxyalkanoic acids and their prodrugs ABBVIE INC. 2004-06-24 US disclosed
WO-2004013085-A1 3-AMINO-2-HRYDROXYALKANOIC ACIDS AND THEIR PRODRUGS ABBOTT LABORATORIES (US) 2004-02-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040122098-A1 3-Amino-2-hydroxyalkanoic acids and their prodrugs HDGF, HCAR2, HCAR3 METAP2 473/4885METAP1 248/4885EPHX1 157/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.