SCHEMBL7419465

SCHEMBL7419465

N=C(NCCCN(Cc1ccc(Br)cc1)c1ncccn1)NCCc1c[nH]cn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 12/20 0.45
SSTR2 P30874 6/20 0.45
GBA1 P04062 12/20 0.41
RAD52 P43351 1/20 0.37
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CHRM5 P08912 1/20 0.35
ADRA2A P08913 1/20 0.35
MAPT P10636 1/20 0.35
CHRM1 P11229 1/20 0.35
ALOX12 P18054 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
FPR1 P21462 1/20 0.35
DRD1 P21728 1/20 0.35
DRD5 P21918 1/20 0.35
SLC6A2 P23975 1/20 0.35
ADRA1D P25100 1/20 0.35
HTR1B P28222 1/20 0.35
HTR2A P28223 1/20 0.35

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
SCHEMBL7425273 0.96 SSTR4 (0.47) SSTR4SSTR2GBA1RAD52MEN1
SCHEMBL7429330 0.91 SSTR4 (0.56) SSTR4SSTR2GBA1RAD52MEN1
SCHEMBL7476252 0.83 SSTR4 (0.61) SSTR4SSTR2GBA1RAD52MEN1
SCHEMBL7477561 0.81 GBA1 (0.45) SSTR4SSTR2GBA1RAD52MEN1
Hydrochloric Acid SCHEMBL7483543 0.80 GBA1 (0.44) SSTR4SSTR2GBA1RAD52MEN1
SCHEMBL7421882 0.78 SSTR4 (0.61) SSTR4SSTR2GBA1RAD52ADRA2A
SCHEMBL7421016 0.77 SSTR4 (0.71) SSTR4SSTR2GBA1RAD52MEN1
Hydrochloric Acid SCHEMBL7423801 0.77 SSTR4 (0.70) SSTR4SSTR2GBA1RAD52MEN1
SCHEMBL7424319 0.76 SSTR4 (0.32) SSTR4MEN1KMT2A
SCHEMBL7421416 0.74 SSTR4 (0.51) SSTR4SSTR2GBA1RAD52ADRA2A

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
EP-1019050-B1 USE OF SOMATOSTATIN AGONISTS AND ANTAGONISTS FOR TREATING DISEASES RELATED TO THE EYE NOVO NORDISK AS (DK) 2002-03-20 EP disclosed
US-6127343-A SELECTIVE, COMPETITIVE SOMATOSTATIN RECEPTOR LIGANDS OF NONPEPTIDE ORIGIN, FOR MEDIATING THE BIOLOGICAL EFFECT OF SOMATOSTATIN AGONISTS OR ANTAGONIST NOVO NORDISK A/S (DK) 2000-10-03 US disclosed
EP-1019050-A1 USE OF SOMATOSTATIN AGONISTS AND ANTAGONISTS FOR TREATING DISEASES RELATED TO THE EYE NOVO NORDISK A/S (DK) 2000-07-19 EP disclosed
EP-0912551-A1 SOMATOSTATIN AGONISTS AND ANTAGONISTS NOVO NORDISK A/S (DK) 1999-05-06 EP disclosed
WO-1998058646-A1 USE OF SOMATOSTATIN AGONISTS AND ANTAGONISTS FOR TREATING DISEASES RELATED TO THE EYE NOVO NORDISK A/S (DK) 1998-12-30 WO disclosed
WO-1997043278-A1 SOMATOSTATIN AGONISTS AND ANTAGONISTS NOVO NORDISK A/S (DK) 1997-11-20 WO disclosed