SCHEMBL5718243

SCHEMBL5718243

COCCC(C(=O)O)N1CCOCC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.47
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38
KDM1A O60341 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
TSHR P16473 1/20 0.35

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
SCHEMBL5718247 0.86 HSD17B10 (0.49) HSD17B10TDP1ALDH1A1NPSR1KMT2A
SCHEMBL5718223 0.84 ALDH1A1 (0.45) HSD17B10ALDH1A1NPSR1KMT2ALMNA
SCHEMBL5718207 0.83 MAPT (0.40) TDP1ALDH1A1NPSR1KMT2ALMNA
SCHEMBL5718231 0.83 MAPT (0.40) TDP1ALDH1A1NPSR1KMT2ALMNA
SCHEMBL18939472 0.81 HSD17B10 (0.50) HSD17B10TDP1ALDH1A1NPSR1KMT2A
SCHEMBL9152732 0.78 HSD17B10 (0.48) HSD17B10ALDH1A1NPSR1KMT2ALMNA
SCHEMBL5718355 0.78 HRH3 (0.35) KMT2AMAPT
SCHEMBL500329 0.78 L3MBTL1 (0.42) HSD17B10TDP1ALDH1A1NPSR1KMT2A
SCHEMBL28094720 0.77 HSD17B10 (0.50) HSD17B10ALDH1A1NPSR1KMT2ALMNA
SCHEMBL24550941 0.77 HSD17B10 (0.53) HSD17B10ALDH1A1NPSR1KMT2ALMNA

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-7141560-B2 Alanine 2,6-dialkoxyphenyl ester derivatives as hypnotics AKZO NOBEL N.V. (NL) 2006-11-28 US disclosed
EP-1373188-B1 ALANINE 2,6-DIALKOXYPHENYL ESTER DERIVATIVES AS HYPNOTICS AKZO NOBEL NV (NL) 2006-06-07 EP disclosed
US-20040059109-A1 Alanine 2, 6-dialkoxyphenyl ester derivatives as hypnotics N.V. ORGANON (NL) 2004-03-25 US disclosed
EP-1373188-A1 ALANINE 2,6-DIALKOXYPHENYL ESTER DERIVATIVES AS HYPNOTICS Akzo Nobel N.V. (NL) 2004-01-02 EP disclosed
WO-2002057218-A1 ALANINE 2,6-DIALKOXYPHENYL ESTER DERIVATIVES AS HYPNOTICS AKZO NOBEL N.V. (NL) 2002-07-25 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-20040059109-A1 Alanine 2, 6-dialkoxyphenyl ester derivatives as hypnotics OPRM1, OPRD1, OPRK1 HSD17B10 965/4885TDP1 2475/4885ALDH1A1 286/4885

“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.