SCHEMBL5501937

SCHEMBL5501937

NCCCCC(N)C(=O)[N]CCCN

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.55
GNAI3 P08754 1/20 0.40
GNAO1 P09471 1/20 0.40
GNAI1 P63096 1/20 0.40
RNPEP Q9H4A4 1/20 0.39
DPP7 Q9UHL4 9/20 0.39
DPP8 Q6V1X1 4/20 0.39
DPP9 Q86TI2 4/20 0.39
DPP4 P27487 1/20 0.39
NOS2 P35228 4/20 0.37
NOS3 P29474 2/20 0.37
NOS1 P29475 2/20 0.37
CYP1A2 P05177 2/20 0.37
TSHR P16473 2/20 0.37
CYP3A4 P08684 1/20 0.37
CPB2 Q96IY4 1/20 0.36
GLA P06280 1/20 0.36
NFKB1 P19838 1/20 0.36
APEX1 P27695 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL5499164 0.94 GSR (0.47) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL6862207 0.94 GSR (0.47) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL6431464 0.94 GSR (0.47) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL5497619 0.90 GSR (0.42) GSRGNAI3GNAO1GNAI1RNPEP
SCHEMBL5502056 0.84 GNAI3 (0.60) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL5502052 0.84 GNAI3 (0.60) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL5497576 0.83 GSR (0.39) GSRNOS2CYP1A2TSHRGLA
SCHEMBL5497774 0.82 GNAI3 (0.58) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL5497784 0.82 GNAI3 (0.58) GSRGNAI3GNAO1GNAI1DPP7
SCHEMBL5499931 0.81 GNAI3 (0.57) GSRGNAI3GNAO1GNAI1DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1100816-B1 AEROTHRICIN ANALOGS, THEIR PREPARATION AND USE BASILEA PHARMACEUTICA AG (CH) 2007-08-08 EP disclosed
EP-1251827-B1 NASALLY ADMINISTRABLE ANTIFUNGAL CYCLIC PEPTIDE COMPOSITIONS BASILEA PHARMACEUTICA AG (CH) 2004-05-26 EP disclosed
US-6489440-B1 Cyclic compounds BASILEA PHARMACEUTICA AG (CH) 2002-12-03 US disclosed
EP-1251827-A2 NASALLY ADMINISTRABLE CYCLIC PEPTIDE COMPOSITIONS Basilea Pharmaceutica AG (CH) 2002-10-30 EP disclosed
US-20010038824-A1 Intranasal cyclic peptide formulations BASILEA PHARMACEUTICA AG (CH) 2001-11-08 US disclosed
WO-2001052894-A2 NASALLY ADMINISTRABLE CYCLIC PEPTIDE COMPOSITIONS BASILEA PHARMACEUTICA AG (CH) 2001-07-26 WO disclosed
EP-1100816-A1 AEROTHRICIN ANALOGS, THEIR PREPARATION AND USE F. HOFFMANN-LA ROCHE AG (CH) 2001-05-23 EP disclosed
WO-2000005251-A1 AEROTHRICIN ANALOGS, THEIR PREPARATION AND USE F. HOFFMANN-LA ROCHE AG (CH) 2000-02-03 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-20010038824-A1 Intranasal cyclic peptide formulations VIP, NPPA, SSTR5 GSR 4171/4885GNAI3 3398/4885GNAO1 3347/4885

“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.