SCHEMBL7430554

SCHEMBL7430554

Cc1cc(Br)cnc1CCCCN(CCCc1c[nH]cn1)C(=N)N

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL7429749 0.83
Iodide SCHEMBL7434001 0.82
SCHEMBL10872426 0.79 GBA1 (0.30)
SCHEMBL7428749 0.78 GBA1 (0.36)
Hydrochloric Acid SCHEMBL9827936 0.78 GBA1 (0.35)
SCHEMBL7426772 0.76
SCHEMBL7430568 0.75 HRH4 (0.37)
SCHEMBL10872427 0.75 HRH2 (0.39)
Hydrochloric Acid SCHEMBL10872130 0.75 HRH2 (0.39)
Hydrochloric Acid SCHEMBL10874377 0.73 HRH2 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0448765-B1 Use of guanidine derivatives for the manufacture of a medicament with NPY-antagonistic activity HEUMANN PHARMA GMBH & CO (DE) 1994-08-17 EP claimed
EP-0448765-A1 Use of guanidine derivatives for the manufacture of a medicament with NPY-antagonistic activity HEUMANN PHARMA GMBH &amp; CO (DE) 1991-10-02 EP claimed
EP-0448765-B1 Use of guanidine derivatives for the manufacture of a medicament with NPY-antagonistic activity HEUMANN PHARMA GMBH & CO (DE) 1994-08-17 EP disclosed
EP-0448765-A1 Use of guanidine derivatives for the manufacture of a medicament with NPY-antagonistic activity HEUMANN PHARMA GMBH &amp; CO (DE) 1991-10-02 EP disclosed