SCHEMBL3926985

SCHEMBL3926985

COCNC(=O)C1(NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CTSL P07711 2/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
EPHX1 P07099 1/20 0.33
CA2 P00918 2/20 0.33
CA12 O43570 1/20 0.33
CA14 Q9ULX7 1/20 0.33
APLNR P35414 1/20 0.33
PPIA P62937 1/20 0.32
CTSB P07858 1/20 0.32
CTSS P25774 1/20 0.32
DRD2 P14416 1/20 0.32
HCRTR2 O43614 1/20 0.32
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
CA1 P00915 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
SCHEMBL2051405 0.94 CTSL (0.35) GHSRTDP1MEN1KMT2ACTSL
SCHEMBL15806208 0.84 GHSR (0.40) GHSRTDP1MEN1KMT2ACTSL
SCHEMBL22148287 0.81 GHSR (0.36) GHSRTDP1MEN1KMT2ACTSL
SCHEMBL8775458 0.81 MME (0.38) GHSRTDP1MEN1KMT2ACTSL
SCHEMBL25325756 0.80 MEN1 (0.36) GHSRTDP1MEN1KMT2ACTSL
SCHEMBL15806170 0.80 TDP1 (0.37) GHSRTDP1MEN1KMT2ACTSL
SCHEMBL15806209 0.80 GHSR (0.35) GHSRTDP1MEN1KMT2ACTSL
SCHEMBL31421142 0.80 TDP1 (0.37) GHSRTDP1MEN1KMT2ACTSL
SCHEMBL5579050 0.80 GHSR (0.35) GHSRTDP1MEN1KMT2ACTSL
SCHEMBL22148500 0.79 CTSL (0.40) GHSRTDP1MEN1KMT2ACTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8084448-B2 Organic compounds NOVARTIS AG (CH) 2011-12-27 US disclosed
US-20090181928-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-07-16 US disclosed
EP-2038267-A2 THIADIAZOLIDINONE INHIBITORS OF PTPASE Novartis AG (CH) 2009-03-25 EP disclosed
EP-1865940-A2 ALPHA KETOAMIDE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS Applera Corporation (US) 2007-12-19 EP disclosed
WO-2007115058-A2 THIADIAZOLIDINONE INHIBITORS OF PTPASE NOVARTIS AG (CH) 2007-10-11 WO disclosed
WO-2006102243-A2 ALPHA KETOAMIDE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS APPLERA CORPORATION (US) 2006-09-28 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-20090181928-A1 ORGANIC COMPOUNDS PTPRS, PTPRO, PTPRC GHSR 787/4885TDP1 1055/4885MEN1 4439/4885

“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.