SCHEMBL15565258

SCHEMBL15565258

Cc1ccc2c(c1)O[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)O)[C@H](C)O)C(=O)N2

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
XIAP P98170 3/20 0.39
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
RIPK1 Q13546 1/20 0.35
TSHR P16473 2/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
HSD17B10 Q99714 2/20 0.33
ALOX15 P16050 1/20 0.33
BRD4 O60885 1/20 0.31

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
SCHEMBL15565283 0.83 USP2 (0.43) USP2GAARIPK1TSHRMEN1
SCHEMBL15564826 0.82 HSD17B10 (0.39) XIAPUSP2GAARIPK1TSHR
SCHEMBL15565004 0.80 RIPK1 (0.41) XIAPUSP2GAARIPK1
SCHEMBL1562110 0.73 PARP1 (0.51) USP2GAARIPK1TSHRMEN1
SCHEMBL1562109 0.73 PARP1 (0.51) USP2GAARIPK1TSHRMEN1
SCHEMBL15564861 0.69 PARP1 (0.55) USP2GAARIPK1TSHRMEN1
SCHEMBL15564765 0.69 PARP1 (0.55) USP2GAARIPK1TSHRMEN1
SCHEMBL17332801 0.69 RIPK1 (0.38) XIAPGAARIPK1MEN1KMT2A
SCHEMBL17332799 0.69 RIPK1 (0.38) XIAPGAARIPK1MEN1KMT2A
SCHEMBL15594303 0.67 BRD4 (0.41) USP2GAATSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9394263-B2 Substituted hetero-azepinones F. HOFFMANN-LA ROCHE AG (CH) 2016-07-19 US disclosed
US-20150361059-A1 SUBSTITUTED HETERO-AZEPINONES HOFFMAN-LA ROCHE INC. (US) 2015-12-17 US disclosed
EP-2882725-A1 SUBSTITUTED HETERO-AZEPINONES F. Hoffmann-La Roche AG (CH) 2015-06-17 EP disclosed
WO-2014023708-A1 SUBSTITUTED HETERO-AZEPINONES F. HOFFMANN-LA ROCHE AG (CH) 2014-02-13 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-20150361059-A1 SUBSTITUTED HETERO-AZEPINONES CCNY, CCNE1, CCND3 XIAP 1935/4885USP2 3627/4885GAA 2880/4885

“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.