SCHEMBL44325

SCHEMBL44325

CCCCc1ccccc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.49
CYP2C9 P11712 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
LIPG Q9Y5X9 1/20 0.47
CYP3A4 P08684 2/20 0.43
CYP2D6 P10635 1/20 0.43
SKP2 Q13309 1/20 0.42
SIGMAR1 Q99720 2/20 0.42
ALDH1A1 P00352 3/20 0.41
HSD17B10 Q99714 2/20 0.41
TYR P14679 1/20 0.39
ALOX15 P16050 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 0.39

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
SCHEMBL29573660 1.00 TLR8 (0.49) TLR8CYP2C9CYP1A2CYP2C19LIPG
Water SCHEMBL27895345 0.98 TLR8 (0.47) TLR8CYP2C9CYP1A2CYP2C19LIPG
Methylamine SCHEMBL27652474 0.98 TLR8 (0.47) TLR8CYP2C9CYP1A2CYP2C19LIPG
Hydrochloric Acid SCHEMBL8802566 0.98 TLR8 (0.47) TLR8CYP2C9CYP1A2CYP2C19LIPG
Alcohol SCHEMBL27345130 0.94 CYP2C9 (0.48) TLR8CYP2C9CYP1A2CYP2C19LIPG
SCHEMBL981336 0.93 LIPG (0.55) TLR8CYP2C9CYP1A2CYP2C19LIPG
Isopropylamine SCHEMBL27685332 0.92 TLR8 (0.44) TLR8CYP2C9CYP1A2CYP2C19LIPG
SCHEMBL4069404 0.91 LIPG (0.58) TLR8CYP2C9CYP1A2CYP2C19LIPG
SCHEMBL634079 0.91 LIPG (0.58) TLR8CYP2C9CYP1A2CYP2C19LIPG
SCHEMBL634069 0.91 LIPG (0.58) TLR8CYP2C9CYP1A2CYP2C19LIPG

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

Appears in 2206 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117926001-A Carbonyl acid extractant for extracting and separating germanium 有研资源环境技术研究院(北京)有限公司 2024-04-26 CN claimed
CN-117736624-A Self-repairing material for fixing hexagonal boron nitride by organic-inorganic hybrid microcapsule 北京航天新立科技有限公司 2024-03-22 CN claimed
EP-4188906-A1 AROMATIC HYDROCARBON-SOLUBLE ANTHRAQUINONE Dow Global Technologies LLC (US) 2023-06-07 EP claimed
CN-111285809-B Green synthesis method of imidazoline under visible light catalysis 杭州师范大学 2023-04-25 CN claimed
WO-2023005682-A1 METHOD FOR ANALYZING TARGETED EXPOSURE GROUP OF ENVIRONMENTAL POLLUTANTS IN PLASMA, AND USE THEREOF 暨南大学 2023-02-02 WO claimed
CN-115386793-A Corrosion-resistant low-alloy seamless steel pipe and preparation method thereof 南通洪源地质工程材料有限公司 2022-11-25 CN claimed
CN-113943422-B Flow pattern regulator and preparation method and application thereof 中国石油天然气集团有限公司 2022-11-01 CN claimed
CN-112898170-B Preparation method of acid diffusion inhibitor and photoresist composition 宁波南大光电材料有限公司 2022-10-04 CN claimed
WO-2022039927-A1 ONE-COMPONENT WATERBORNE POLYURETHANE SELF-HEALING COATINGS USING HYDROPHOBIC BLOCKED POLYISOCYANATES COVESTRO LLC (US) 2022-02-24 WO claimed
WO-2022026225-A1 AROMATIC HYDROCARBON-SOLUBLE ANTHRAQUINONE DOW GLOBAL TECHNOLOGIES LLC (US) 2022-02-03 WO claimed
US-4579957-A REACTING AN AROMATIC DIALDEHYDE WITH AN AROMATIC AMINE, REACTING PRODUCT WITH MALEIC ANHYDRIDE MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1986-04-01 US claimed
EP-0172611-A2 Epoxy resin curing agent, compositions containing it; coated abrasives made therewith and process for making coated abrasives MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1986-02-26 EP claimed
EP-0099268-B1 PROCESS FOR PRODUCING POLYMALEIMIDE MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1986-01-22 EP claimed
EP-0166321-A2 Hydrophobic polyamides BAYER AG (DE) 1986-01-02 EP claimed
US-4553982-A AROMATIC AMINE SALT OF SUBSTITUTED PENTAFLUOROANTIMONIC ACID AS CU MINNESOTA MINING AND MANUFACTURING CO. (US) 1985-11-19 US claimed
US-4503211-A GOOD POT LIFE MINNESOTA MINING AND MANUFACTURING CO. (US) 1985-03-05 US claimed
US-4434832-A CURING GUM RUBBER IN HOLLOW AREA, APPLYING AMINE CURABLE POLYMER AND CURED PATCH THE FIRESTONE TIRE & RUBBER COMPANY (US) 1984-03-06 US claimed
EP-0099268-A1 Process for producing polymaleimide MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1984-01-25 EP claimed
US-4360621-A FOR RUBBERS AND POLYURETHANES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-11-23 US claimed
US-4076537-A Light-sensitive materials containing organo tellurium or selenium compounds and sensitizers FUJI PHOTO FILM CO., LTD. (JA) 1978-02-28 US claimed