SCHEMBL5074010

SCHEMBL5074010

CC(C)C(NC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1)P(=O)(O)O

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 2/20 0.62
CTSL P07711 5/20 0.61
CTSB P07858 3/20 0.61
CTSS P25774 1/20 0.61
CTSK P43235 1/20 0.61
ELANE P08246 2/20 0.58
PRTN3 P24158 1/20 0.55
CAPN1 P07384 1/20 0.54

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
SCHEMBL7620929 0.88 TACR1 (0.65) TACR1CTSLCTSBCTSSCTSK
SCHEMBL2353877 0.88 ELANE (0.72) CTSLCTSBCTSSCTSKELANE
SCHEMBL2353879 0.88 ELANE (0.72) CTSLCTSBCTSSCTSKELANE
SCHEMBL6132175 0.86 TACR1 (0.54) TACR1CTSLCTSBCTSSCTSK
SCHEMBL10802556 0.84 CTSL (0.70) TACR1CTSLCTSBCTSSCTSK
SCHEMBL19807564 0.84 TACR1 (0.72) TACR1CTSLCTSBCTSSCTSK
SCHEMBL7275434 0.82 ECE1 (0.65) TACR1CTSLCTSBCTSSCTSK
SCHEMBL10967811 0.82 CAPN1 (0.72) TACR1CTSLCTSBCTSSCTSK
SCHEMBL31397615 0.82 CAPN1 (0.72) TACR1CTSLCTSBCTSSCTSK
SCHEMBL9088735 0.82 CAPN1 (0.72) TACR1CTSLCTSBCTSSCTSK

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 TACR1 640/4885CTSL 105/4885CTSB 195/4885

“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.