SCHEMBL575701

SCHEMBL575701

CCSCc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.50
CYP2C19 P33261 2/20 0.48
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 1/20 0.47
PRMT1 Q99873 1/20 0.43
IDO1 P14902 3/20 0.43
NOS3 P29474 1/20 0.43
NOS1 P29475 1/20 0.43
NOS2 P35228 1/20 0.43
ALDH1A1 P00352 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42
MAOB P27338 1/20 0.42
POLB P06746 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CALM1 P0DP23 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
Ammonia Solution, Strong SCHEMBL28733157 0.97 TP53 (0.48) TP53CYP2C19CYP1A2CYP3A4CYP2D6
SCHEMBL28084539 0.97 TP53 (0.48) TP53CYP2C19CYP1A2CYP3A4CYP2D6
Cyclohexane SCHEMBL28084538 0.93 TP53 (0.44) TP53CYP2C19CYP1A2CYP3A4CYP2D6
SCHEMBL20734753 0.86 IDO1 (0.39) CYP2C19CYP1A2CYP2D6CYP2C9IDO1
Propane SCHEMBL27610651 0.84 TP53 (0.50) TP53CYP2C19CYP1A2CYP3A4CYP2D6
SCHEMBL206 0.83 CYP2C19 (0.56) CYP2C19CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL20734675 0.82 ACHE (0.46) TP53CYP1A2IDO1ALDH1A1
Methyl Alcohol SCHEMBL29261078 0.81 CYP2C19 (0.56) TP53CYP2C19CYP1A2CYP3A4CYP2D6
SCHEMBL7136112 0.80 CYP2C19 (0.54) CYP2C19CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL5209412 0.80 CYP2C19 (0.54) CYP2C19CYP1A2CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115651017-B Method for selectively preparing benzyl or alkyl phosphine oxide compound based on benzyl thioether derivative 中南大学 2025-05-27 CN claimed
CN-118852618-A Resin composition 旭化成株式会社 2024-10-29 CN claimed
CN-115651017-A Method for selectively preparing benzyl or alkyl phosphine oxide compound based on benzyl thioether derivative 中南大学 2023-01-31 CN claimed
CN-112195200-A Method for synthesizing chiral sulfoxide compound through enzyme catalysis 韩嘉欣 2021-01-08 CN claimed
CN-105732859-B Sulfur-tail-end-containing polymer and preparation method thereof 中国石油天然气股份有限公司 2018-06-01 CN claimed
CN-105732859-A Sulfur-tail-end-containing polymer and preparation method thereof 中国石油天然气股份有限公司 2016-07-06 CN claimed
EP-1339662-A1 NOVEL ESTROGEN RECEPTOR LIGANDS AND METHODS III KARO BIO AB (SE) 2003-09-03 EP claimed
WO-2002046134-A1 NOVEL ESTROGEN RECEPTOR LIGANDS AND METHODS III KARO BIO AB (SE) 2002-06-13 WO claimed
US-6096836-A OXYGEN CONTAINING AROMATIC CATALYST AND ALUMINUM COMPOUND KABUSHIKI KAISHA TOSHIBA (JP) 2000-08-01 US claimed
US-4110234-A PHENYLATED NAPHTHYLAMINE, SULFUR COMPOUND, METAL UNIROYAL, INC. (US) 1978-08-29 US claimed
CN-115651017-B Method for selectively preparing benzyl or alkyl phosphine oxide compound based on benzyl thioether derivative 中南大学 2025-05-27 CN disclosed
CN-119462730-A Sulfur-containing onium ion compound, preparation method and application thereof 中国科学院苏州纳米技术与纳米仿生研究所 2025-02-18 CN disclosed
CN-118852618-A Resin composition 旭化成株式会社 2024-10-29 CN disclosed
US-12100809-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-24 US disclosed
US-20240297344-A1 NONAQUEOUS ELECTROLYTE FOR SECONDARY BATTERY AND NONAQUEOUS-ELECTROLYTE SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-05 US disclosed
US-4035375-A N-Substituted amino pyridines and derivatives thereof THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1977-07-12 US disclosed
US-4000188-A ANIONIC SURFACTANTS CIBA-GEIGY CORPORATION (US) 1976-12-28 US disclosed
US-3985756-A Process for producing azasulfonium salts and rearrangement thereof to thio-ethers THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1976-10-12 US disclosed
US-3948916-A HYDANTOINS OR URACILS, POLYEPOXIDES CIBA-GEIGY AG (CH) 1976-04-06 US disclosed
US-3931058-A POLYGLYCIDYL COMPOUNDS, PROCESSES FOR THEIR MANUFACTURE AND USE CIBA-GEIGY AG (CH) 1976-01-06 US disclosed