SCHEMBL2497438

SCHEMBL2497438

CC(O)C(CO[Si](C)(C)C(C)(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA7 P43166 2/20 0.49
CYP2D6 P10635 1/20 0.41
CTSK P43235 8/20 0.38
KMT2A Q03164 1/20 0.37
CTSS P25774 3/20 0.37
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CA4 P22748 1/20 0.36
CA9 Q16790 1/20 0.36
CTSL P07711 1/20 0.35
CTSB P07858 1/20 0.35
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GLS O94925 1/20 0.34
KLK5 Q9Y337 1/20 0.34

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
SCHEMBL16638818 1.00 CA1 (0.49) CA1CA2CA7CYP2D6CTSK
SCHEMBL15215101 1.00 CA1 (0.49) CA1CA2CA7CYP2D6CTSK
SCHEMBL16317020 0.90 CA1 (0.58) CA1CA2CA7CYP2D6CTSK
SCHEMBL2492647 0.87 CA1 (0.48) CA1CA2CA7CYP2D6CTSK
SCHEMBL12191651 0.87 CA1 (0.48) CA1CA2CA7CYP2D6CTSK
SCHEMBL26748578 0.85 CA1 (0.45) CA1CA2CA7CYP2D6CTSK
SCHEMBL3198135 0.85 CA1 (0.42) CA1CA2CA7CYP2D6CTSK
SCHEMBL16690443 0.83 CYP2D6 (0.47) CA1CA2CA7CYP2D6CTSK
SCHEMBL16690460 0.83 CA1 (0.44) CA1CA2CA7CYP2D6CTSK
SCHEMBL5001764 0.83 CA1 (0.45) CA1CA2CA7CYP2D6CTSK

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-8030279-B2 Tamandarin analogs and fragments thereof and methods of making and using THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2011-10-04 US disclosed
EP-1613338-A4 TAMANDARIN ANALOGS AND FRAGMENTS THEREOF AND METHODS OF MAKING AND USING JOULLIE MADELEINE M (US) 2009-06-24 EP disclosed
US-20070149446-A1 Tamandarin analogs and fragments thereof and methods of making and using THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA CENTER FOR TECHNOLOGY TRANSFER (US) 2007-06-28 US disclosed
EP-1613338-A2 TAMANDARIN ANALOGS AND FRAGMENTS THEREOF AND METHODS OF MAKING AND USING Joullie, Madeleine M. (US) 2006-01-11 EP disclosed
WO-2004084812-A2 TAMANDARIN ANALOGS AND FRAGMENTS THEREOF AND METHODS OF MAKING AND USING JOULLIE MADELEINE M (US) 2004-10-07 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-20070149446-A1 Tamandarin analogs and fragments thereof and methods of making and using FOXM1, F3, RB1 CA1 3440/4885CA2 3845/4885CA7 2452/4885

“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.