SCHEMBL4901697

SCHEMBL4901697

CCOC(=O)[C@@H](N)CCCNC(=N)NS(=O)(=O)c1c(C)cc(OC)c(C)c1C

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 5/20 0.42
F2 P00734 2/20 0.41
AVPR1A P37288 8/20 0.40
NMT1 P30419 2/20 0.36
PLG P00747 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
Hydrochloric Acid SCHEMBL4901689 0.99 AVPR1B (0.42) AVPR1BF2AVPR1ANMT1PLG
SCHEMBL22139318 0.94 AVPR1B (0.43) AVPR1BF2AVPR1ANMT1PLG
SCHEMBL30038580 0.94 AVPR1B (0.43) AVPR1BF2AVPR1ANMT1PLG
SCHEMBL24136539 0.94 AVPR1B (0.43) AVPR1BF2AVPR1ANMT1PLG
SCHEMBL18468371 0.90 AVPR1B (0.45) AVPR1BF2AVPR1ANMT1PLG
SCHEMBL29918117 0.90 AVPR1B (0.41) AVPR1BF2AVPR1ANMT1PLG
SCHEMBL28823513 0.90 AVPR1B (0.41) AVPR1BF2AVPR1ANMT1PLG
Hydrochloric Acid SCHEMBL29918226 0.89 AVPR1B (0.40) AVPR1BF2AVPR1ANMT1PLG
Hydrochloric Acid SCHEMBL18049425 0.88 AVPR1B (0.42) AVPR1BF2AVPR1ANMT1PLG
Hydrochloric Acid SCHEMBL19923044 0.88 AVPR1B (0.42) AVPR1BF2AVPR1ANMT1PLG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080280920-A1 Plasminogen Activator Inhibitor-1 Inhibitors AMERICAN DIAGNOSTICA INC. 2008-11-13 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-20080280920-A1 Plasminogen Activator Inhibitor-1 Inhibitors SERPINE1, SERPINC1, SERPINB1 AVPR1B 1428/4885F2 21/4885AVPR1A 1065/4885

“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.