SCHEMBL5875808

SCHEMBL5875808

CCCCOC(CC)N(c1nc(N)nc(NC(O)CC)n1)C(O)CC

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
SCHEMBL193075 0.85
SCHEMBL5875882 0.83 ALDH1A1 (0.31)
SCHEMBL27642131 0.75 TSHR (0.35)
SCHEMBL6700072 0.70 HTR7 (0.33)
SCHEMBL8201839 0.70 LMNA (0.31)
SCHEMBL195696 0.70 HTR7 (0.34)
Methoxymethane SCHEMBL27642128 0.69 NPC1 (0.31)
SCHEMBL8603167 0.68 KCNH2 (0.38)
SCHEMBL8601291 0.68 KCNH2 (0.38)
SCHEMBL11539504 0.67 MAPT (0.36)

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-1608692-B1 MELAMINE AND GUANAMINE-BASED CROSSLINKING COMPOSITION ALLNEX USA INC (US) 2013-12-25 EP disclosed
US-7034086-B2 Melamine and guanamine-based crosslinking composition CYTEC TECHNOLOGY CORP. (US) 2006-04-25 US disclosed
EP-1608692-A1 MELAMINE AND GUANAMINE-BASED CROSSLINKING COMPOSITION CYTEC TECHNOLOGY CORP. (US) 2005-12-28 EP disclosed
WO-2004094498-A1 MELAMINE AND GUANAMINE-BASED CROSSLINKING COMPOSITION CYTEC TECHNOLOGY CORP. (US) 2004-11-04 WO disclosed
US-20040198908-A1 Melamine and guanamine-based crosslinking composition ALLNEX NETHERLANDS B.V. (NL) 2004-10-07 US disclosed