SCHEMBL5875882

SCHEMBL5875882

CCC(O)Nc1nc(N)nc(N(C(O)CC)C(O)CC)n1

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31
GAA P10253 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
KDM4E B2RXH2 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL193075 0.88
SCHEMBL5875808 0.83
SCHEMBL8201839 0.82 LMNA (0.31)
SCHEMBL6700072 0.82 HTR7 (0.33) ALDH1A1GAACYP1A2L3MBTL1KDM4E
SCHEMBL11539504 0.82 MAPT (0.36)
Methoxymethane SCHEMBL27642128 0.77 NPC1 (0.31) CYP1A2KMT2A
SCHEMBL3295987 0.72 KMT2A (0.39) ALDH1A1GAACYP1A2CYP2C19L3MBTL1
SCHEMBL2778045 0.71 ALDH1A1 (0.37) ALDH1A1GAAKDM4EKMT2A
SCHEMBL5789076 0.71 L3MBTL1 (0.41) ALDH1A1GAACYP1A2CYP2C19L3MBTL1
SCHEMBL11375176 0.70 ALDH1A1 (0.32) ALDH1A1GAAKDM4EKMT2A

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