SCHEMBL6307075

SCHEMBL6307075

CC([O])C(=O)NCC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.64
MAPT P10636 2/20 0.64
LMNA P02545 1/20 0.64
PTGS2 P35354 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
ECE1 P42892 2/20 0.55
MME P08473 6/20 0.53
ACE P12821 4/20 0.53
CPA1 P15085 1/20 0.53
ACE2 Q9BYF1 1/20 0.53
EGLN1 Q9GZT9 2/20 0.43
CTH P32929 1/20 0.39
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
BLM P54132 1/20 0.38
NPEPPS P55786 1/20 0.38
KMT2A Q03164 1/20 0.38
APEX1 P27695 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
SCHEMBL9146654 0.83 ALDH1A1 (0.61) ALDH1A1MAPTLMNAPTGS2TDP1
(Isobutyrylamino)Acetic Acid SCHEMBL622544 0.82 ALDH1A1 (0.67) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL6307083 0.80 ALDH1A1 (0.64) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL11800572 0.79 ALDH1A1 (0.57) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL1329382 0.78 ALDH1A1 (0.61) ALDH1A1MAPTLMNAPTGS2TDP1
Tiopronin SCHEMBL9847854 0.78 ALDH1A1 (1.00) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL851239 0.78 ALDH1A1 (0.61) ALDH1A1MAPTLMNAPTGS2TDP1
Tiopronin SCHEMBL19989 0.78 ALDH1A1 (1.00) ALDH1A1MAPTLMNAPTGS2TDP1
SCHEMBL3008983 0.78 ALDH1A1 (0.61) ALDH1A1MAPTLMNAPTGS2TDP1
Tiopronin SCHEMBL3009491 0.78 ALDH1A1 (1.00) ALDH1A1MAPTLMNAPTGS2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6906058-B2 1,5-Benzothiazepines and their use as hypolipidaemics ASTRAZENECA AB (SE) 2005-06-14 US claimed
EP-1263747-B1 1,5-BENZOTHIAZEPINES AND THEIR USE AS HYPOLIPIDAEMICS ASTRAZENECA AB (SE) 2004-11-24 EP claimed
US-20030166927-A1 1,5-Benzothiazepines and their use as hypolipidaemics ALBIREO AB (SE) 2003-09-04 US claimed
EP-1263747-A1 1,5-BENZOTHIAZEPINES AND THEIR USE AS HYPOLIPIDAEMICS AstraZeneca AB (SE) 2002-12-11 EP claimed
WO-2001066533-A1 1,5-BENZOTHIAZEPINES AND THEIR USE AS HYPOLIPIDAEMICS ASTRAZENECA AB (SE) 2001-09-13 WO claimed
US-6906058-B2 1,5-Benzothiazepines and their use as hypolipidaemics ASTRAZENECA AB (SE) 2005-06-14 US disclosed
EP-1263747-B1 1,5-BENZOTHIAZEPINES AND THEIR USE AS HYPOLIPIDAEMICS ASTRAZENECA AB (SE) 2004-11-24 EP disclosed
US-20030166927-A1 1,5-Benzothiazepines and their use as hypolipidaemics ALBIREO AB (SE) 2003-09-04 US disclosed
EP-1263747-A1 1,5-BENZOTHIAZEPINES AND THEIR USE AS HYPOLIPIDAEMICS AstraZeneca AB (SE) 2002-12-11 EP disclosed
WO-2001066533-A1 1,5-BENZOTHIAZEPINES AND THEIR USE AS HYPOLIPIDAEMICS ASTRAZENECA AB (SE) 2001-09-13 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-20030166927-A1 1,5-Benzothiazepines and their use as hypolipidaemics SLC10A2, SLC10A1, LCAT ALDH1A1 811/4885MAPT 1147/4885LMNA 2733/4885

“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.