SCHEMBL7038864

SCHEMBL7038864

CN(C(=O)OC(C)(C)C)C(=NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA7 P43166 1/20 0.30
CA14 Q9ULX7 1/20 0.30
PTGES O14684 1/20 0.30

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
SCHEMBL16808277 1.00 CA12 (0.30) CA12CA1CA7CA14PTGES
SCHEMBL8193600 0.85 CTSK (0.33) CA12CA1CA7CA14PTGES
SCHEMBL8193597 0.85 CTSK (0.33) CA12CA1CA7CA14PTGES
SCHEMBL19465020 0.85 CTSK (0.33) CA12CA1CA7CA14PTGES
SCHEMBL24671528 0.83
SCHEMBL24670538 0.82 CA12 (0.31) CA12CA1CA7CA14PTGES
SCHEMBL16808293 0.80
SCHEMBL19236012 0.80 CA12 (0.34) CA12CA1CA7CA14PTGES
SCHEMBL24669520 0.79 CA1 (0.36) CA12CA1CA7CA14PTGES
SCHEMBL19460142 0.79 CA12 (0.35) CA12CA1CA7CA14PTGES

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030055214-A1 Guanidinylation reagents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-03-20 US claimed
EP-0983232-B1 GUANIDINYLATION REAGENTS UNIV CALIFORNIA (US) 2002-11-13 EP claimed
US-6072075-A Guanidinylation reagents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-06-06 US claimed
US-20030055214-A1 Guanidinylation reagents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-03-20 US disclosed
EP-0983232-B1 GUANIDINYLATION REAGENTS UNIV CALIFORNIA (US) 2002-11-13 EP disclosed
US-6380358-B1 USING IN SOLID PHASE SYNTHESIS; FOR EXAMPLE, N-N'-DI-BOC-N?-TRIFLUOROMETHMESULFONYL-GUANIDINE TO YIELD N-PROTECTED GUANIDINE DERIVATIVES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2002-04-30 US disclosed
US-6072075-A Guanidinylation reagents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-06-06 US disclosed
EP-0983232-A2 GUANIDINYLATION REAGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-03-08 EP disclosed
WO-1998052917-A2 GUANIDINYLATION REAGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-11-26 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-20030055214-A1 Guanidinylation reagents GDA, GMPS, GNMT CA12 4765/4885CA1 4741/4885CA7 3853/4885

“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.