SCHEMBL5076556

SCHEMBL5076556

COC(=O)C(O)CCCN

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CYP1A2 P05177 1/20 0.38
ZDHHC7 Q9NXF8 1/20 0.37
CPB2 Q96IY4 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.34
GSR P00390 1/20 0.34
GPR84 Q9NQS5 3/20 0.33
PAOX Q6QHF9 2/20 0.33
RNPEP Q9H4A4 1/20 0.33
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
FFAR1 O14842 1/20 0.33
ANPEP P15144 1/20 0.33
EPOR P19235 1/20 0.33
ABCB1 P08183 1/20 0.33

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
SCHEMBL7826438 1.00 CA1 (0.39) CA1CA2CYP1A2ZDHHC7CPB2
SCHEMBL6873312 0.92 CPB2 (0.46) CA1CA2ZDHHC7CPB2GSR
SCHEMBL1555156 0.86
SCHEMBL7741435 0.86
SCHEMBL1556637 0.86
Hydrochloric Acid SCHEMBL5317901 0.84 GABRR1 (0.38) CA1CA2CYP1A2ZDHHC7CPB2
Hydrochloric Acid SCHEMBL1094574 0.84 GABRR1 (0.38) CA1CA2CYP1A2ZDHHC7CPB2
SCHEMBL7947554 0.80 CA2 (0.61) CA1CA2ZDHHC7GPR84FFAR1
SCHEMBL149523 0.80 CA2 (0.61) CA1CA2ZDHHC7GPR84FFAR1
SCHEMBL29253175 0.80 CA1 (0.41) CA1CA2ZDHHC7SMN1; SMN2GPR84

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-7423012-B2 Phosphinyloxy, oxime and carboxylic acid derivatives which are useful as carboxypeptidase U inhibitors ASTRAZENECA AB (SE) 2008-09-09 US disclosed
US-7354895-B1 Phosphinyloxy, oxime and carboxylic acid derivatives which are useful as carboxypeptidase U inhibitors ASTRAZENECA AB (SE) 2008-04-08 US disclosed
US-20060079484-A1 Phosphinyloxy, oxime and carboxylic acid derivatives which are useful as carboxypeptidase U inhibitors LINSCHOTEN MARCEL 2006-04-13 US disclosed
EP-1180099-A1 NEW COMPOUNDS AstraZeneca AB (SE) 2002-02-20 EP disclosed
WO-2000066550-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 2000-11-09 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-20060079484-A1 Phosphinyloxy, oxime and carboxylic acid derivatives which are useful as carboxypeptidase U inhibitors CPN1, CPA1, DNPEP CA1 46/4885CA2 16/4885CYP1A2 1722/4885

“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.