SCHEMBL3689664

SCHEMBL3689664

CCCCC(CC)COc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
MAPT P10636 5/20 0.49
GAA P10253 2/20 0.49
CRHBP P24387 1/20 0.49
CRHR2 Q13324 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
PTGS2 P35354 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
MGLL Q99685 2/20 0.46
BCL9 O00512 1/20 0.44
CTNNB1 P35222 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
CA2 P00918 1/20 0.43
CYP3A4 P08684 1/20 0.43
KCNH2 Q12809 1/20 0.42

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
SCHEMBL3691103 0.92 MAPT (0.47) ALDH1A1MAPTGAACRHBPCRHR2
SCHEMBL19201789 0.88 ALDH1A1 (0.57) ALDH1A1MAPTGAACRHBPCRHR2
SCHEMBL1356320 0.84 ALDH1A1 (0.50) ALDH1A1L3MBTL1CA2CYP3A4
SCHEMBL1357035 0.84 ALDH1A1 (0.50) ALDH1A1L3MBTL1CA2CYP3A4
SCHEMBL14942540 0.84 ALDH1A1 (0.54) ALDH1A1MAPTGAACRHBPCRHR2
SCHEMBL15881894 0.84 CHRNB2 (0.50) ALDH1A1NPC1CA2CYP3A4
SCHEMBL7805047 0.83 ALDH1A1 (0.67) ALDH1A1MAPTGAACRHBPCRHR2
SCHEMBL1496684 0.83 ALDH1A1 (0.67) ALDH1A1MAPTGAACRHBPCRHR2
SCHEMBL11676956 0.82 MAPT (0.49) ALDH1A1MAPTGAANPC1RAB9A
SCHEMBL27594002 0.82 CA1 (0.61) ALDH1A1MAPTCRHBPCRHR2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2009082-B1 Synergistic lubricating oil composition containing a mixture of a nitro-substituted diarylamine and a diarylamine CHEVRON ORONITE CO (US) 2017-08-30 EP disclosed
EP-2009082-B1 Synergistic lubricating oil composition containing a mixture of a nitro-substituted diarylamine and a diarylamine CHEVRON ORONITE CO (US) 2017-08-30 EP disclosed
US-20170044373-A1 CHROMOPHORES FOR PHOTOCHROMIC COMPOSITIONS USEFUL FOR THREE DIMENSIONAL DISPLAY APPLICATIONS NITTO DENKO CORPORATION (JP) 2017-02-16 US disclosed
US-20170044373-A1 CHROMOPHORES FOR PHOTOCHROMIC COMPOSITIONS USEFUL FOR THREE DIMENSIONAL DISPLAY APPLICATIONS NITTO DENKO CORPORATION (JP) 2017-02-16 US disclosed
WO-2015164390-A1 CHROMOPHORES FOR PHOTOCHROMIC COMPOSITIONS USEFUL FOR THREE DIMENSIONAL DISPLAY APPLICATIONS NITTO DENKO CORPORATION (JP) 2015-10-29 WO disclosed
US-7683017-B2 Synergistic lubricating oil composition containing a mixture of a nitro-substituted diarylamine and a diarylamine CHEVRON ORONITE COMPANY LLC (US) 2010-03-23 US disclosed
US-7683017-B2 Synergistic lubricating oil composition containing a mixture of a nitro-substituted diarylamine and a diarylamine CHEVRON ORONITE COMPANY LLC (US) 2010-03-23 US disclosed
US-7683017-B2 Synergistic lubricating oil composition containing a mixture of a nitro-substituted diarylamine and a diarylamine CHEVRON ORONITE COMPANY LLC (US) 2010-03-23 US disclosed
EP-2009082-A2 Synergistic lubricating oil composition containing a mixture of a nitro-substituted diarylamine and a diarylamine Chevron Oronite Company LLC (US) 2008-12-31 EP disclosed
EP-2009082-A2 Synergistic lubricating oil composition containing a mixture of a nitro-substituted diarylamine and a diarylamine Chevron Oronite Company LLC (US) 2008-12-31 EP disclosed
US-20080318815-A1 SYNERGISTIC LUBRICATING OIL COMPOSITION CONTAINING A MIXTURE OF A NITRO-SUBSTITUTED DIARYLAMINE AND A DAIRYLAMINE CHEVRON ORONITE COMPANY LLC 2008-12-25 US disclosed
US-20080318815-A1 SYNERGISTIC LUBRICATING OIL COMPOSITION CONTAINING A MIXTURE OF A NITRO-SUBSTITUTED DIARYLAMINE AND A DAIRYLAMINE CHEVRON ORONITE COMPANY LLC 2008-12-25 US disclosed
US-20080318815-A1 SYNERGISTIC LUBRICATING OIL COMPOSITION CONTAINING A MIXTURE OF A NITRO-SUBSTITUTED DIARYLAMINE AND A DAIRYLAMINE CHEVRON ORONITE COMPANY LLC 2008-12-25 US disclosed
EP-1081140-B1 Novel Pyrimidine-2,4,6-trione compounds DSM IP ASSETS BV (NL) 2005-06-01 EP disclosed
US-6573269-B1 Compounds for protecting surface of substrate from ultraviolet light ROCHE VITAMINS INC. 2003-06-03 US disclosed
EP-1081140-A2 Novel Pyrimidine-2,4,6-trione compounds F. HOFFMANN-LA ROCHE AG (CH) 2001-03-07 EP disclosed