SCHEMBL573146

SCHEMBL573146

Cc1cc(N2CCCCCC2)ccc1[N+](=O)[O-]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 1.00
MAPT P10636 14/20 0.67
ALDH1A1 P00352 9/20 0.67
CYP1A2 P05177 4/20 0.67
CYP2C19 P33261 4/20 0.67
CYP2C9 P11712 3/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
LMNA P02545 2/20 0.65
KMT2A Q03164 2/20 0.64
CYP3A4 P08684 1/20 0.61
SMN1; SMN2 Q16637 2/20 0.59
NPSR1 Q6W5P4 1/20 0.59
MAPK1 P28482 2/20 0.58
MEN1 O00255 1/20 0.57
HTT P42858 1/20 0.56

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
SCHEMBL3837554 1.00 HPGD (1.00) HPGDMAPTALDH1A1CYP1A2CYP2C19
SCHEMBL6653754 0.98 HPGD (0.97) HPGDMAPTALDH1A1CYP1A2CYP2C19
SCHEMBL7050664 0.94 HPGD (0.88) HPGDMAPTALDH1A1CYP1A2CYP2C19
SCHEMBL170932 0.86 HPGD (0.75) HPGDMAPTALDH1A1L3MBTL1MAPK1
SCHEMBL5202277 0.86 HPGD (0.74) HPGDMAPTALDH1A1CYP1A2CYP2C19
SCHEMBL27518071 0.85 HPGD (0.74) HPGDMAPTALDH1A1CYP1A2CYP2C19
SCHEMBL25855470 0.85 HPGD (0.73) HPGDMAPTALDH1A1CYP1A2CYP2C19
SCHEMBL29788558 0.84 HPGD (0.73) HPGDMAPTALDH1A1CYP1A2CYP2C19
SCHEMBL14419529 0.84 HPGD (0.73) HPGDMAPTALDH1A1CYP1A2CYP2C19
SCHEMBL1920553 0.84 HPGD (0.73) HPGDMAPTALDH1A1CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2601556-A1 PHOTOREFRACTIVE COMPOSITION RESPONSIVE TO MULTIPLE LASER WAVELENGTHS ACROSS THE VISIBLE LIGHT SPECTRUM Nitto Denko Corporation (JP) 2013-06-12 EP disclosed
US-20130128339-A1 PHOTOREFRACTIVE COMPOSITION RESPONSIVE TO MULTIPLE LASER WAVELENGTHS ACROSS THE VISIBLE LIGHT SPECTRUM NITTO DENKO CORPORATION (JP) 2013-05-23 US disclosed
US-20130128339-A1 PHOTOREFRACTIVE COMPOSITION RESPONSIVE TO MULTIPLE LASER WAVELENGTHS ACROSS THE VISIBLE LIGHT SPECTRUM NITTO DENKO CORPORATION (JP) 2013-05-23 US disclosed
US-20130128339-A1 PHOTOREFRACTIVE COMPOSITION RESPONSIVE TO MULTIPLE LASER WAVELENGTHS ACROSS THE VISIBLE LIGHT SPECTRUM NITTO DENKO CORPORATION (JP) 2013-05-23 US disclosed
WO-2012018342-A1 PHOTOREFRACTIVE COMPOSITION RESPONSIVE TO MULTIPLE LASER WAVELENGTHS ACROSS THE VISIBLE LIGHT SPECTRUM NITTO DENKO CORPORATION (JP) 2012-02-09 WO disclosed
WO-2012018342-A1 PHOTOREFRACTIVE COMPOSITION RESPONSIVE TO MULTIPLE LASER WAVELENGTHS ACROSS THE VISIBLE LIGHT SPECTRUM NITTO DENKO CORPORATION (JP) 2012-02-09 WO disclosed
EP-1512684-A1 use of derivative of para-phenylenediamine substituted by a homopiperidine ring, for the dyeing of keratinous fibres L'OREAL (FR) 2005-03-09 EP disclosed