SCHEMBL2439337

SCHEMBL2439337

CC(C)(C)OC(=O)N1CC[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1[C@@H](CNC(=O)OCc1ccccc1)c1c[nH]c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.40
KLK7 P49862 1/20 0.39
TACR1 P25103 2/20 0.37
KLK5 Q9Y337 1/20 0.37
SYK P43405 1/20 0.37
SSTR2 P30874 3/20 0.36
CCKBR P32239 1/20 0.36
CCKAR P32238 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL2117903 0.92 TGM2 (0.41) ABCB1KLK7SYKMEN1KMT2A
SCHEMBL13448819 0.88 ABCB1 (0.42) ABCB1KLK7TACR1SYKSSTR2
SCHEMBL2440589 0.88 ABCB1 (0.42) ABCB1KLK7TACR1SYKSSTR2
SCHEMBL2437013 0.88 KLK7 (0.40) ABCB1KLK7TACR1KLK5SYK
SCHEMBL2442750 0.84 SSTR2 (0.37) SSTR2MEN1KMT2A
SCHEMBL12299472 0.84 SSTR2 (0.37) SSTR2MEN1KMT2A
SCHEMBL2442154 0.82 TGM2 (0.41) ABCB1KLK7KLK5SYK
SCHEMBL12299669 0.82 TGM2 (0.41) ABCB1KLK7KLK5SYK
SCHEMBL2436780 0.82 TGM2 (0.41) ABCB1KLK7KLK5SYK
SCHEMBL12299704 0.82 TGM2 (0.41) ABCB1KLK7KLK5SYK

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-8399683-B2 IAP inhibitors TETRALOGIC PHARMACEUTICALS (US) 2013-03-19 US disclosed
US-8399683-B2 IAP inhibitors TETRALOGIC PHARMACEUTICALS (US) 2013-03-19 US disclosed
US-8399683-B2 IAP inhibitors TETRALOGIC PHARMACEUTICALS (US) 2013-03-19 US disclosed
US-20110237517-A1 IAP INHIBITORS TETRALOGIC PHARMACEUTICALS CORP. 2011-09-29 US disclosed
US-20110237517-A1 IAP INHIBITORS TETRALOGIC PHARMACEUTICALS CORP. 2011-09-29 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-20110237517-A1 IAP INHIBITORS XIAP, IAPP, BIRC5 ABCB1 393/4885KLK7 2479/4885TACR1 2755/4885

“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.