SCHEMBL5853008

SCHEMBL5853008

CCCCCOC(=O)C(N)(CCN)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.42
NAAA Q02083 1/20 0.41
HTR2C P28335 1/20 0.41
HCAR2 Q8TDS4 2/20 0.40
FAAH O00519 1/20 0.38
ACHE P22303 6/20 0.38
TSHR P16473 3/20 0.38
ALDH1A1 P00352 1/20 0.36
FDPS P14324 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36
RAD52 P43351 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL5852966 0.87 NAAA (0.43) EPHX1NAAAHTR2CHCAR2FAAH
SCHEMBL28914773 0.86 ALDH1A1 (0.39) HTR2CHCAR2TSHRALDH1A1FDPS
SCHEMBL28914772 0.86 ALDH1A1 (0.39) HTR2CHCAR2TSHRALDH1A1FDPS
Acetic Acid SCHEMBL11697268 0.83 ALDH1A1 (0.41) HTR2CHCAR2TSHRALDH1A1FDPS
Acetic Acid SCHEMBL11697282 0.83 ALDH1A1 (0.41) HTR2CHCAR2TSHRALDH1A1FDPS
SCHEMBL8754911 0.82 NAAA (0.46) EPHX1NAAAHTR2CHCAR2FAAH
SCHEMBL8755187 0.82 NAAA (0.46) EPHX1NAAAHTR2CHCAR2FAAH
SCHEMBL5204094 0.81 ALDH1A1 (0.44) EPHX1NAAAHTR2CHCAR2ACHE
SCHEMBL27530078 0.81 ACHE (0.41) HCAR2ACHETSHRALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL7377198 0.80 ALDH1A1 (0.42) EPHX1NAAAHTR2CHCAR2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7030214-B2 Ureins derived from α, ω, diamino acids and process for their preparation SOLVAY (SOCIETE ANONYME) (BE) 2006-04-18 US disclosed
US-20020058784-A1 Ureins derived from alpha, omega, -diamond acids and process for their preparation CALLENS ROLAND (BE) 2002-05-16 US disclosed
US-6310178-B1 AS THE N-TERMINAL RESIDUE OF BIOLOGICALLY ACTIVE PEPTIDES, E.G, THYROTROPIN RELEASING HORMONE (BY REPLACING THE N-TERMINAL PYROGLUTAMYL GROUP); IMPARTING INCREASED RESISTANCE TO PROTEOLYTIC DIGESTION SOLVAY, S.A. (BE) 2001-10-30 US 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-20020058784-A1 Ureins derived from alpha, omega, -diamond acids and process for their preparation UPP1, URB2, UFM1 EPHX1 1259/4885NAAA 565/4885HTR2C 3969/4885

“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.