Hexanal

Hexanal

SCHEMBL2449154

CCCCCC=O.OCCO

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.75
FAAH O00519 2/20 0.65
TRPV1 Q8NER1 2/20 0.65
ALDH1A1 P00352 4/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
LMNA P02545 2/20 0.46
HSD17B10 Q99714 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HIF1A Q16665 1/20 0.45
EPHX1 P07099 1/20 0.42
ADH1B P00325 1/20 0.42
ADH1C P00326 1/20 0.42
ADH1A P07327 1/20 0.42
ADH4 P08319 1/20 0.42
ADH7 P40394 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
Palmitaldehyde SCHEMBL6162415 0.97 TSHR (0.80) TSHRFAAHTRPV1ALDH1A1SMN1; SMN2
Tridecanal SCHEMBL9083185 0.97 TSHR (0.80) TSHRFAAHTRPV1ALDH1A1SMN1; SMN2
Heptanal SCHEMBL2454694 0.97 TSHR (0.80) TSHRFAAHTRPV1ALDH1A1SMN1; SMN2
Octanal SCHEMBL2453523 0.97 TSHR (0.80) TSHRFAAHTRPV1ALDH1A1SMN1; SMN2
Hexanal SCHEMBL28119013 0.92 TSHR (0.79) TSHRFAAHTRPV1ALDH1A1SMN1; SMN2
Pentanal SCHEMBL2453810 0.92 TSHR (0.78) TSHRFAAHTRPV1ALDH1A1SMN1; SMN2
Hexanal SCHEMBL2635617 0.90 TSHR (0.76) TSHRFAAHTRPV1ALDH1A1SMN1; SMN2
Dodecanol SCHEMBL8387775 0.90 TSHR (0.76) TSHRFAAHTRPV1ALDH1A1SMN1; SMN2
Hexanal SCHEMBL5504335 0.90 TSHR (0.76) TSHRFAAHTRPV1ALDH1A1SMN1; SMN2
Hexanal SCHEMBL28743151 0.90 TSHR (0.76) TSHRFAAHTRPV1ALDH1A1SMN1; SMN2

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
US-20230038633-A1 DIALIPHATIC KETONE MIXTURES, COMPOSITIONS COMPRISING SAME AND USE THEREOF SOLVAY SA (BE) 2023-02-09 US disclosed
CN-114845686-A Mixtures of dialiphatic ketones, compositions comprising the same and uses thereof 索尔维公司 2022-08-02 CN disclosed
WO-2021122005-A1 DIALIPHATIC KETONE MIXTURES, COMPOSITIONS COMPRISING SAME AND USE THEREOF SOLVAY SA (BE) 2021-06-24 WO disclosed
EP-3837982-A1 WAX DISPERSIONS SUITABLE FOR THE COATING OF FOOD PRODUCTS COMPRISING KETONES WITH A MELTING POINT ABOVE 40°C Solvay SA (BE) 2021-06-23 EP disclosed
EP-2550332-B1 POLYMER COMPOSITIONS COMPRISING SEMI-AROMATIC POLYAMIDES AND GRAPHENE MATERIALS SOLVAY (BE) 2018-05-16 EP disclosed
US-9139732-B2 Polymer compositions comprising semi-aromatic polyamides and graphene materials SOLVAY SA (BE) 2015-09-22 US disclosed
CN-204536338-U A kind of water quality VOC monitor ZHEJIANG YINUO ENVIRONMENTAL PROT TECHNOLOGY CO LTD 2015-08-05 CN disclosed
EP-2889928-A1 Improved photoactive compositions Solvay SA (BE) 2015-07-01 EP disclosed
US-20130072613-A1 Polymer compositions comprising semi-aromatic polyamides and graphene materials SOLVAY SA (BE) 2013-03-21 US disclosed
EP-2550332-A2 POLYMER COMPOSITIONS COMPRISING SEMI-AROMATIC POLYAMIDES AND GRAPHENE MATERIALS Solvay SA (BE) 2013-01-30 EP disclosed
EP-2550333-A2 POLYAMIDE COMPOSITIONS COMPRISING A SUBSTANCE COMPRISING ALKYLENE OXIDE MOIETIES Solvay SA (BE) 2013-01-30 EP disclosed
US-20130018136-A1 Polyamide compositions comprising a substance comprising alkylene oxide moieties SOLVAY SA (BE) 2013-01-17 US disclosed
WO-2011117326-A2 POLYAMIDE COMPOSITIONS COMPRISING A SUBSTANCE COMPRISING ALKYLENE OXIDE MOIETIES SOLVAY SA (BE) 2011-09-29 WO disclosed
WO-2011117325-A2 POLYMER COMPOSITIONS COMPRISING SEMI-AROMATIC POLYAMIDES AND GRAPHENE MATERIALS SOLVAY SA (BE) 2011-09-29 WO disclosed
US-5130413-A Forming a metal salt of the polyoxyalkylene oxide by reaction with alkali metal alkoxide and reaction with a halogen unsaturated compound KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1992-07-14 US disclosed
EP-0415404-A2 Process for producing unsaturated group-terminated high-molecular weight polyalkylene oxide KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-03-06 EP disclosed