SCHEMBL8074332

SCHEMBL8074332

Nc1[c]cc([N+](=O)[O-])[c]c1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33

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
SCHEMBL5581181 0.85 MEN1 (0.35) ALDH1A1
SCHEMBL1921008 0.71 ALDH1A1 (0.46) ALDH1A1
SCHEMBL2096918 0.68 SMN1; SMN2 (0.34) ALDH1A1
SCHEMBL8082519 0.68 MAPT (0.34) ALDH1A1
SCHEMBL8819993 0.67 NSD2 (0.32)
SCHEMBL3885956 0.67 ALDH1A1 (0.52) ALDH1A1
SCHEMBL11405352 0.65 TDP1 (0.48) ALDH1A1
SCHEMBL867459 0.65
SCHEMBL18603 0.64 ALDH1A1 (0.43) ALDH1A1
SCHEMBL2886629 0.64 CYP3A4 (0.39) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650534-A Optically active smectic photo-cross-linkable liquid crystals ROLIC AG (CH) 1997-07-22 US claimed
CN-1082993-C Optically active smectic photo-cross-linkable liquid crystals ROLIC AG (CH) 2002-04-17 CN disclosed
US-6143208-A Optical element and compounds used in its manufacture ROLIC AG (CH) 2000-11-07 US disclosed
EP-0699731-B1 Optically avtive smectic photo-curable liquid crystals ROLIC AG (CH) 2000-10-04 EP disclosed
US-5650534-A Optically active smectic photo-cross-linkable liquid crystals ROLIC AG (CH) 1997-07-22 US disclosed
EP-0520281-B1 Optical element for generating short wave laser light HOFFMANN LA ROCHE (CH) 1997-03-12 EP disclosed
CN-1126748-A Optically active smectic photo-cross-linkable liquid crystals HOFFMANN LA ROCHE (CH) 1996-07-17 CN disclosed
EP-0699731-A2 Optically avtive smectic photo-curable liquid crystals F. HOFFMANN-LA ROCHE AG (CH) 1996-03-06 EP disclosed
US-5335303-A Quasi-phased matched optical waveguide frequency conversion element having a ferroelectric liquid crystalline material exhibiting a periodic structure HOFFMANN-LA ROCHE INC. (US) 1994-08-02 US disclosed
EP-0520281-A2 Optical element for generating short wave laser light F. HOFFMANN-LA ROCHE AG (CH) 1992-12-30 EP disclosed