SCHEMBL4193434

SCHEMBL4193434

N=C(N)NN=CCCc1cc(O)cn1-c1cccc(C(Cl)(Cl)Cl)c1

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
SCHEMBL4193429 1.00 — —
SCHEMBL12123960 0.79 POLB (0.30) —
SCHEMBL12657860 0.71 — —
SCHEMBL5180841 0.71 MTNR1A (0.34) —
SCHEMBL4184349 0.69 SMN1; SMN2 (0.34) —
SCHEMBL4184346 0.69 SMN1; SMN2 (0.34) —
SCHEMBL5180028 0.68 ALDH1A1 (0.34) —
SCHEMBL5180033 0.68 ALDH1A1 (0.34) —
SCHEMBL12123706 0.68 — —
SCHEMBL4179685 0.68 KDM4E (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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1414440-B1 N-PHENYLPYRROLE GUANIDINE DERIVATIVES AS MELANOCORTIN RECEPTOR LIGANDS ACTION PHARMA AS (DK) 2007-01-10 — — EP claimed
US-20060148798-A1 N-phenylpyrrole guanidine derivatives as melanocortin receptor ligands ACTION PHARMA A/S (DK) 2006-07-06 — — US claimed
US-20090018183-A1 N-phenylpyrrole guanidine derivatives as melanocortin receptor ligands ACTION PHARMA A/S (DK) 2009-01-15 — — US disclosed
EP-1414440-B1 N-PHENYLPYRROLE GUANIDINE DERIVATIVES AS MELANOCORTIN RECEPTOR LIGANDS ACTION PHARMA AS (DK) 2007-01-10 — — EP disclosed
US-20060148798-A1 N-phenylpyrrole guanidine derivatives as melanocortin receptor ligands ACTION PHARMA A/S (DK) 2006-07-06 — — US disclosed
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