SCHEMBL4599802

SCHEMBL4599802

CCCCc1ccccc1P

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.47
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
TLR8 Q9NR97 1/20 0.41
TYR P14679 1/20 0.39
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
CYSLTR2 Q9NS75 5/20 0.38
CYSLTR1 Q9Y271 5/20 0.38
ALOX5 P09917 1/20 0.38
PTGS2 P35354 1/20 0.38

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
Hydrochloric Acid SCHEMBL11572415 0.98 LIPG (0.46) LIPGCYP3A4CYP2D6CYP2C9TLR8
Hydrochloric Acid SCHEMBL29193831 0.98 LIPG (0.46) LIPGCYP3A4CYP2D6CYP2C9TLR8
Bromide SCHEMBL29193845 0.98 LIPG (0.46) LIPGCYP3A4CYP2D6CYP2C9TLR8
SCHEMBL5139629 0.93 LIPG (0.55) LIPGTLR8NR1H2NR1H3CYSLTR2
Hydrochloric Acid SCHEMBL25265752 0.91 LIPG (0.53) LIPGTLR8NR1H2NR1H3CYSLTR2
SCHEMBL18660547 0.91 LIPG (0.58) LIPGNR1H2NR1H3CYSLTR2CYSLTR1
SCHEMBL8519828 0.91 LIPG (0.58) LIPGNR1H2NR1H3CYSLTR2CYSLTR1
SCHEMBL11004527 0.91 LIPG (0.58) LIPGNR1H2NR1H3CYSLTR2CYSLTR1
SCHEMBL338793 0.91 LIPG (0.58) LIPGNR1H2NR1H3CYSLTR2CYSLTR1
SCHEMBL11269006 0.91 LIPG (0.58) LIPGNR1H2NR1H3CYSLTR2CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119707617-A Method for reducing alkyne into alkene by using water as hydrogen source 长春工业大学 2025-03-28 CN claimed
EP-3484840-A1 CATALYTIC PROCESS FOR DIENE DIMERIZATION Total Raffinage Chimie (FR) 2019-05-22 EP claimed
WO-2018011157-A1 CATALYTIC PROCESS FOR DIENE DIMERIZATION TOTAL RAFFINAGE CHIMIE (FR) 2018-01-18 WO claimed
EP-1622861-A1 METHOD OF FORMING A CARBON-HETEROATOM BOND RHODIA CHIMIE (FR) 2006-02-08 EP claimed
WO-2004101496-A1 METHOD OF FORMING A CARBON-HETEROATOM BOND RHODIA CHIMIE (FR) 2004-11-25 WO claimed
WO-2001042197-A1 METHOD FOR PREPARING A POLYAROMATIC COMPOUND RHODIA CHIMIE (FR) 2001-06-14 WO claimed
EP-0975571-A1 METHOD FOR PREPARING AROMATIC ALDEHYDES RHODIA CHIMIE (FR) 2000-02-02 EP claimed
WO-1999042424-A1 METHOD FOR PREPARING AROMATIC KETONE COMPOUNDS RHODIA CHIMIE (FR) 1999-08-26 WO claimed
WO-1998047848-A1 METHOD FOR PREPARING AROMATIC ALDEHYDES RHODIA CHIMIE (FR) 1998-10-29 WO claimed
JP-1060623-A None JP disclosed
CN-119707617-A Method for reducing alkyne into alkene by using water as hydrogen source 长春工业大学 2025-03-28 CN disclosed
EP-4341239-A1 PROCESS FOR PREPARING SUBSTITUTED BIPHENYLS VIA SUZUKI COUPLING OF ARYL-CHLORIDES BASF SE (DE) 2024-03-27 EP disclosed
EP-4314108-A1 EPOXY RESIN COMPOSITION, PREPREG, AND FIBER-REINFORCED COMPOSITE MATERIAL Toray Industries, Inc. (JP) 2024-02-07 EP disclosed
EP-4276092-A1 COMPOUND LIBRARY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-11-15 EP disclosed
US-4265827-A METHYLCYCOHEXYL-O-ANISYLARSINE OPTICALLY ACTIVE CATALYST MONSANTO COMPANY (US) 1981-05-05 US disclosed
US-4261919-A OF BETA-SUBSTITUTED-ALPHA-ACYLAMIDO-ACRYLIC ACIDS TO YIELD OPTICALLY ACTIVE MIXTURE MONSANTO COMPANY (US) 1981-04-14 US disclosed
US-4124533-A HYDROGENATION CATALYSTS MONSANTO COMPANY (US) 1978-11-07 US disclosed
US-4119652-A HYDROGENATION CATALYSTS; COORDINATION COMPOUNDS OF IRIDIUM, RHODIUM OR RUTHENIUM WITH PHOSPHINE OR ARSINE LIGANDS; OPTICALLY ACTIVE MONSANTO COMPANY (US) 1978-10-10 US disclosed
US-4092288-A WITH A PHOSPHINE AND AN EPOXY COMPOUND GENERAL ELECTRIC COMPANY (US) 1978-05-30 US disclosed
US-3968147-A COORDINATION CATALYST MONSANTO COMPANY (US) 1976-07-06 US disclosed