SCHEMBL4405593

SCHEMBL4405593

N=C(N)NCCCCCC(N)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.50
OTC P00480 1/20 0.49
NOS2 P35228 6/20 0.47
NOS1 P29475 4/20 0.47
NOS3 P29474 3/20 0.47
DDAH1 O94760 3/20 0.46
ARG2 P78540 4/20 0.46
ARG1 P05089 3/20 0.46
CYP1A2 P05177 3/20 0.45
TSHR P16473 2/20 0.45
CYP3A4 P08684 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GLA P06280 1/20 0.44
NFKB1 P19838 1/20 0.44
APEX1 P27695 1/20 0.44
CYP2C19 P33261 1/20 0.44
GNAI3 P08754 1/20 0.44
GNAO1 P09471 1/20 0.44

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
SCHEMBL4225043 1.00 GSR (0.50) GSROTCNOS2NOS1NOS3
SCHEMBL4225929 1.00 GSR (0.50) GSROTCNOS2NOS1NOS3
SCHEMBL4221548 1.00 GSR (0.50) GSROTCNOS2NOS1NOS3
SCHEMBL43287 0.98 GSR (0.52) GSROTCNOS2NOS1NOS3
SCHEMBL28754154 0.98 GSR (0.52) GSROTCNOS2NOS1NOS3
SCHEMBL10071054 0.98 GSR (0.52) GSROTCNOS2NOS1NOS3
SCHEMBL880728 0.98 GSR (0.52) GSROTCNOS2NOS1NOS3
SCHEMBL27615800 0.98 GSR (0.52) GSROTCNOS2NOS1NOS3
Arginine SCHEMBL5152371 0.96 OTC (0.53) GSROTCNOS2NOS1NOS3
Hydrochloric Acid SCHEMBL21045047 0.96 GSR (0.50) GSROTCNOS2NOS1NOS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11179471-B2 Peptide for cytosolic delivery KYOTO UNIVERSITY (JP) 2021-11-23 US claimed
US-20200046840-A1 PEPTIDE FOR CYTOSOLIC DELIVERY KYOTO UNIVERSITY (JP) 2020-02-13 US claimed
EP-3604520-A1 PEPTIDE FOR CYTOSOLIC DELIVERY Kyoto University (JP) 2020-02-05 EP claimed
US-11179471-B2 Peptide for cytosolic delivery KYOTO UNIVERSITY (JP) 2021-11-23 US disclosed
US-20200046840-A1 PEPTIDE FOR CYTOSOLIC DELIVERY KYOTO UNIVERSITY (JP) 2020-02-13 US disclosed
EP-3604520-A1 PEPTIDE FOR CYTOSOLIC DELIVERY Kyoto University (JP) 2020-02-05 EP disclosed
US-20090180958-A1 Diagnostic and therapeutic agents KARYON-CTT LTD. (FI) 2009-07-16 US disclosed
EP-1874800-A1 DIAGNOSTIC AND THERAPEUTIC AGENTS Karyon-CTT Ltd (FI) 2008-01-09 EP disclosed
US-20060275213-A1 Tumor targeting agents and uses thereof KARYON OY (FI) 2006-12-07 US disclosed
US-20060263294-A1 Tumor targeting agents and uses thereof KARYON OY (FI) 2006-11-23 US disclosed
WO-2006114478-A1 DIAGNOSTIC AND THERAPEUTIC AGENTS KARYON-CTT LTD (FI) 2006-11-02 WO disclosed
EP-1549667-A1 TUMOR TARGETING AGENTS AND USES THEREOF Karyon OY (FI) 2005-07-06 EP disclosed
EP-1549668-A1 TUMOR TARGETING AGENTS AND USES THEREOF Karyon OY (FI) 2005-07-06 EP disclosed
EP-1549669-A1 TUMOR TARGETING AGENTS AND USES THEREOF Karyon OY (FI) 2005-07-06 EP disclosed
WO-2004031221-A9 TUMOR TARGETING AGENTS AND USES THEREOF KARYON OY (FI) 2004-07-08 WO disclosed
WO-2004031221-A1 TUMOR TARGETING AGENTS AND USES THEREOF KARYON OY (FI) 2004-04-15 WO disclosed
WO-2004031218-A1 TUMOR TARGETING AGENTS AND USES THEREOF KARYON OY (FI) 2004-04-15 WO disclosed
WO-2004031219-A1 TUMOR TARGETING AGENTS AND USES THEREOF KARYON OY (FI) 2004-04-15 WO disclosed
WO-2004031220-A1 TUMOR TARGETING AGENTS AND USES THEREOF KARYON OY (FI) 2004-04-15 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 (3 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-20060275213-A1 Tumor targeting agents and uses thereof CCL2, CCL5, SCTR GSR 4146/4885OTC 3603/4885NOS2 4461/4885
US-20090180958-A1 Diagnostic and therapeutic agents TPX2, ZFX, ZYX GSR 1377/4885OTC 3137/4885NOS2 4646/4885
US-20060263294-A1 Tumor targeting agents and uses thereof CRACR2A, FGB, EWSR1 GSR 3035/4885OTC 2421/4885NOS2 2998/4885

“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.