SCHEMBL1415067

SCHEMBL1415067

COC(=O)CNC(=O)C(C)(C)NC(=O)[C@@H](CSC(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)[C@@H](Cc1cccnc1)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.43
CTSB P07858 3/20 0.43
PTPN1 P18031 6/20 0.39
MDM4 O15151 1/20 0.39
TP53 P04637 1/20 0.39
GRB2 P62993 1/20 0.37
SCN9A Q15858 1/20 0.37

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
SCHEMBL1415070 1.00 CTSL (0.43) CTSLCTSBPTPN1MDM4TP53
SCHEMBL1410759 0.89 MDM4 (0.44) MDM4TP53
SCHEMBL1410753 0.89 MDM4 (0.44) MDM4TP53
SCHEMBL1409105 0.89 CTSL (0.41) CTSLCTSBPTPN1MDM4TP53
SCHEMBL1409102 0.89 CTSL (0.41) CTSLCTSBPTPN1MDM4TP53
SCHEMBL12601389 0.87 CTSL (0.40) CTSLCTSBPTPN1MDM4TP53
SCHEMBL1770944 0.84 PTPN1 (0.41) PTPN1MDM4TP53GRB2
SCHEMBL12509956 0.82 PTPN1 (0.45) PTPN1MDM4TP53
SCHEMBL2199171 0.81 PTPN1 (0.44) PTPN1MDM4TP53
SCHEMBL2199165 0.81 PTPN1 (0.44) PTPN1MDM4TP53

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-8614193-B2 Depsipeptides and their therapeutic use KARUS THERAPEUTICS LIMITED (GB) 2013-12-24 US disclosed
EP-2293846-B1 Depsipeptides and their therapeutic use KARUS THERAPEUTICS LTD (GB) 2013-07-10 EP disclosed
US-20110112090-A1 Depsipeptides and Their Therapeutic Use KARUS THERAPEUTICS LIMITED (GB) 2011-05-12 US disclosed
EP-2293846-A1 DEPSIPEPTIDES AND THEIR THERAPEUTIC USE Karus Therapeutics Limited (GB) 2011-03-16 EP disclosed
WO-2009141658-A1 DEPSIPEPTIDES AND THEIR THERAPEUTIC USE KARUS THERAPEUTICS LIMITED (GB) 2009-11-26 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-20110112090-A1 Depsipeptides and Their Therapeutic Use PRLHR, OPRD1, NPR3 CTSL 2736/4885CTSB 3793/4885PTPN1 2258/4885

“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.