SCHEMBL1401823

SCHEMBL1401823

CNc1ccc(NOCCO)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APP P05067 17/20 0.46
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
CASP1 P29466 1/20 0.36
RECQL P46063 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TSHR P16473 1/20 0.36
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35

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
SCHEMBL28630486 0.83 MAPT (0.41) ALDH1A1TP53THRBHPGDALOX15
SCHEMBL8752152 0.81 APP (0.36) APPALDH1A1RECQLHSD17B10TSHR
SCHEMBL6131910 0.81 CA2 (0.38) APPALDH1A1TP53CYP3A4THRB
SCHEMBL33691 0.79 MAPT (0.39) APPALDH1A1TP53CYP3A4THRB
SCHEMBL10697594 0.78 ALDH1A1 (0.46) ALDH1A1TP53CYP3A4HPGDALOX15
SCHEMBL3639538 0.75 APP (0.68) APPALDH1A1RECQL
SCHEMBL9442096 0.75 APP (0.41) APPALDH1A1TP53HPGD
SCHEMBL691644 0.72 TSHR (0.46) APPALDH1A1TP53CYP3A4THRB
SCHEMBL14590749 0.70 TSHR (0.43) APPALDH1A1TP53CYP3A4THRB
SCHEMBL14075726 0.69 HPGD (0.50) ALDH1A1CYP3A4THRBHPGDRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4312961-A1 HAIR TREATMENT COMPOSITIONS WITH AMINE DERIVATIVES ELC Management LLC (US) 2024-02-07 EP disclosed
WO-2012175688-A2 EMULSION DYEING COMPOSITION CONTAINING AN AMINE OR A PHOSPHOLIPID, AT LEAST ONE NONIONIC SURFACTANT AND AT LEAST ONE CARBOXYLIC ACID, AND METHOD OF USING SAME L'OREAL (FR) 2012-12-27 WO disclosed
WO-2012175685-A2 EMULSION DYEING COMPOSITION CONTAINING AN AMINE OR A PHOSPHOLIPID, AT LEAST ONE NONIONIC SURFACTANT AND AT LEAST ONE SILICONE, AND METHOD OF USING SAME L'OREAL (FR) 2012-12-27 WO disclosed
WO-2012175687-A2 EMULSION DYEING COMPOSITION CONTAINING AN AMINE OR A PHOSPHOLIPID, AT LEAST ONE NONIONIC SURFACTANT AND AT LEAST ONE PHOSPHATE ESTER, AND METHOD OF USING SAME L'OREAL (FR) 2012-12-27 WO disclosed
EP-2291172-A2 OXIDATIVE HAIR DYE COMPOSITIONS, METHODS AND PRODUCTS Aveda Corporation (US) 2011-03-09 EP disclosed
WO-2009134618-A2 OXIDATIVE HAIR DYE COMPOSITIONS, METHODS AND PRODUCTS AVEDA CORPORATION (US) 2009-11-05 WO disclosed
WO-2002089748-A2 METHOD AND COMPOSITIONS FOR COLORING HAIR REVLON CONSUMER PRODUCTS CORPORATION (US) 2002-11-14 WO disclosed
WO-2001045649-A1 WATER IN OIL MICROEMULSION PEROXIDE COMPOSITIONS FOR USE IN OXIDATIVE DYEING OF HAIR AND RELATED METHODS REVLON CONSUMER PRODUCTS CORPORATION (US) 2001-06-28 WO disclosed
WO-2000076469-A1 ONE STEP METHOD AND COMPOSITIONS FOR SIMULTANEOUSLY COLORING AND HIGHLIGHTING HAIR REVLON CONSUMER PRODUCTS CORPORATION (US) 2000-12-21 WO disclosed