Propene

Propene

SCHEMBL127283

C=CC.Nc1ccc(N)c([N+](=O)[O-])c1

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.79
TDP1 Q9NUW8 5/20 0.79
CYP3A4 P08684 4/20 0.79
ALOX15 P16050 2/20 0.79
TSHR P16473 4/20 0.58
RECQL P46063 1/20 0.58
MEN1 O00255 3/20 0.56
POLB P06746 3/20 0.56
KMT2A Q03164 3/20 0.56
MAPT P10636 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.53
MAPK1 P28482 1/20 0.53
HSD17B10 Q99714 1/20 0.53
PKM P14618 1/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
MCL1 Q07820 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL9286039 0.89 ALDH1A1 (0.79) ALDH1A1TDP1CYP3A4ALOX15TSHR
SCHEMBL29358067 0.89 ALDH1A1 (1.00) ALDH1A1TDP1CYP3A4ALOX15TSHR
SCHEMBL78083 0.89 ALDH1A1 (1.00) ALDH1A1TDP1CYP3A4ALOX15TSHR
Hydrochloric Acid SCHEMBL3336452 0.87 ALDH1A1 (0.96) ALDH1A1TDP1CYP3A4ALOX15TSHR
Methane SCHEMBL28048595 0.87 ALDH1A1 (0.96) ALDH1A1TDP1CYP3A4ALOX15TSHR
SCHEMBL23824901 0.87 ALDH1A1 (0.96) ALDH1A1TDP1CYP3A4ALOX15TSHR
Hydrochloric Acid SCHEMBL1883446 0.87 ALDH1A1 (0.96) ALDH1A1TDP1CYP3A4ALOX15TSHR
Hydrochloric Acid SCHEMBL28120789 0.85 ALDH1A1 (0.92) ALDH1A1TDP1CYP3A4ALOX15TSHR
Carbamic Acid SCHEMBL28268243 0.80 ALDH1A1 (0.81) ALDH1A1TDP1CYP3A4ALOX15TSHR
Sulfuric Acid SCHEMBL1882494 0.80 ALDH1A1 (0.81) ALDH1A1TDP1CYP3A4ALOX15TSHR

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 62 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2140853-B1 Coated particle for use in cosmetics HENKEL AG & CO KGAA (DE) 2018-07-18 EP claimed
EP-1776085-B1 AGENT CONTAINING AN ALKALISATION AGENT FOR LIGHTENING AND/OR COLOURING KERATIN FIBRES HENKEL AG & CO KGAA (DE) 2010-04-28 EP claimed
EP-2140853-A2 Coated particle for use in cosmetics Henkel AG & Co. KGaA (DE) 2010-01-06 EP claimed
EP-1752191-B1 Agent for bleaching and/or colouring keratinic fibres with a coated alkaline agent HENKEL AG & CO KGAA (DE) 2008-09-10 EP claimed
EP-1787631-A1 New dye precursor combinations HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-05-23 EP claimed
WO-2007048473-A1 HAIR COLOURING AND/OR LIGHTENING METHOD WITH IMPROVED EFFICIENCY ACHIEVED BY UV LIGHT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-05-03 WO claimed
EP-1776085-A1 AGENT CONTAINING AN ALKALISATION AGENT FOR LIGHTENING AND/OR COLOURING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-04-25 EP claimed
EP-1771145-A1 AGENTS FOR THE SIMULTANEOUS DYEING AND BLEACHING OF KERATIN-CONTAINING FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2007-04-11 EP claimed
EP-1752191-A1 Agent for bleaching and/or colouring keratinic fibres with a coated alkaline agent Henkel Kommanditgesellschaft auf Aktien (DE) 2007-02-14 EP claimed
WO-2006045454-A1 AGENT COMPRISING SILYL-CARBONATE OR -CARBAMATE FOR THE SIMULTANEOUS COLOURING AND BLEACHING OF FIBRES CONTAINING KERATIN HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-05-04 WO claimed
WO-2006018099-A1 AGENT CONTAINING AN ALKALISATION AGENT FOR LIGHTENING AND/OR COLOURING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-02-23 WO claimed
WO-2005123019-A1 AGENTS FOR THE SIMULTANEOUS DYEING AND BLEACHING OF KERATIN-CONTAINING FIBERS HENKEL KOMMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-12-29 WO claimed
EP-2140853-B1 Coated particle for use in cosmetics HENKEL AG & CO KGAA (DE) 2018-07-18 EP disclosed
WO-2015096834-A1 AGENT AND METHOD FOR THE TEMPORARY SHAPING OF KERATIN FIBERS HENKEL AG & CO. KGAA (DE) 2015-07-02 WO disclosed
EP-1771145-B1 Agents for the simultaneous dyeing and bleaching of keratin-containing fibers HENKEL AG & CO KGAA (DE) 2012-11-21 EP disclosed
EP-1669108-B1 Odour-reducing hair treatment and composition HENKEL AG & CO KGAA (DE) 2012-03-07 EP disclosed
WO-2006024334-A1 AGENTS FOR COLOURING FIBRES CONTAINING KERATIN HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-03-09 WO disclosed
WO-2006018099-A1 AGENT CONTAINING AN ALKALISATION AGENT FOR LIGHTENING AND/OR COLOURING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-02-23 WO disclosed
WO-2005123021-A1 BLEACHING AGENTS COMPRISING CARBONIC ACID DERIVATIVES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-12-29 WO disclosed
WO-2005123019-A1 AGENTS FOR THE SIMULTANEOUS DYEING AND BLEACHING OF KERATIN-CONTAINING FIBERS HENKEL KOMMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-12-29 WO disclosed