SCHEMBL7040592

SCHEMBL7040592

CN(C)CCN(C)CCNC(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
CTSD P07339 1/20 0.54
ALDH1A1 P00352 3/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
HPGD P15428 2/20 0.50
HTT P42858 2/20 0.49
TMEM97 Q5BJF2 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL13753116 0.79 CTSD (0.64) LMNACTSDALDH1A1MEN1KMT2A
SCHEMBL9492867 0.78 CTSD (0.66) LMNACTSDALDH1A1MEN1KMT2A
SCHEMBL28738502 0.78 CTSD (0.66) LMNACTSDALDH1A1MEN1KMT2A
SCHEMBL11554301 0.77 NPC1 (0.65) LMNAALDH1A1HPGDHTTTMEM97
SCHEMBL4960015 0.77 HTT (0.69) LMNACTSDALDH1A1MEN1KMT2A
SCHEMBL7425750 0.76 CTSD (0.64) LMNACTSDALDH1A1MEN1KMT2A
SCHEMBL11719219 0.76 CTSD (0.64) LMNACTSDALDH1A1MEN1KMT2A
SCHEMBL22163884 0.76 CTSD (0.69) LMNACTSDALDH1A1MEN1KMT2A
SCHEMBL7038868 0.76 TMEM97 (0.70) LMNAALDH1A1MEN1KMT2AHTT
SCHEMBL13753006 0.76 CTSD (0.68) LMNACTSDALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1052248-B1 Process for the preparation of aqueous solutions of diazonium salts CLARIANT GMBH (DE) 2003-03-19 EP disclosed
US-6207809-B1 CATALYTIC HYDROGENATION USING THE CORRESPONDING NITRO COMPOUND CLARIANT GMBH (DE) 2001-03-27 US disclosed
EP-1052248-A1 Process for the preparation of aqueous solutions of diazonium salts Clariant GmbH (DE) 2000-11-15 EP disclosed