SCHEMBL40597

SCHEMBL40597

Cc1ccccc1C(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.56
GABRA1 P14867 3/20 0.52
GABRB2 P47870 2/20 0.52
TSHR P16473 3/20 0.50
ACHE P22303 2/20 0.50
GABRG2 P18507 2/20 0.48
GABRB3 P28472 2/20 0.48
FAAH O00519 2/20 0.48
SLC6A2 P23975 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
HPGD P15428 1/20 0.48
GABRB1 P18505 1/20 0.48
PTGS1 P23219 1/20 0.48
HTR2C P28335 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48

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
SCHEMBL29392590 1.00 ESR1 (0.56) ESR1GABRA1GABRB2TSHRACHE
SCHEMBL5493731 1.00 ESR1 (0.56) ESR1GABRA1GABRB2TSHRACHE
Fluoride SCHEMBL28113471 0.97 ESR1 (0.54) ESR1GABRA1GABRB2TSHRACHE
SCHEMBL27612057 0.97 ESR1 (0.54) ESR1GABRA1GABRB2TSHRACHE
Ammonia Solution, Strong SCHEMBL15769983 0.97 ESR1 (0.54) ESR1GABRA1GABRB2TSHRACHE
Water SCHEMBL3656564 0.97 ESR1 (0.54) ESR1GABRA1GABRB2TSHRACHE
Iodide SCHEMBL29230048 0.97 ESR1 (0.54) ESR1GABRA1GABRB2TSHRACHE
SCHEMBL30142944 0.97 ESR1 (0.54) ESR1GABRA1GABRB2TSHRACHE
SCHEMBL31498556 0.97 ESR1 (0.54) ESR1GABRA1GABRB2TSHRACHE
Hydrogen Peroxide SCHEMBL10348374 0.95 GABRA1 (0.54) ESR1GABRA1GABRB2TSHRACHE

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 3983 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12635710-B2 Methods of using formaldehyde-free antimicrobial compositions in animal by-product compositions EASTMAN CHEMICAL COMPANY (US) 2026-05-26 US claimed
US-20260092228-A1 COMPOSITIONS FOR FUEL BLENDING MADE BY A SUSTAINABLE PROCESS, AND SUSTAINABLE FUEL COMPOSITIONS THEREFROM VISOLIS INC (US) 2026-04-02 US claimed
US-20250185660-A1 METHODS AND COMPOSITIONS FOR DISRUPTING HERBIVOROUS PESTS AND REDUCING CROP DAMAGE USING PREDATORY INSECT SEMIOCHEMICALS THE PENN STATE RESEARCH FOUNDATION 2025-06-12 US claimed
US-20250110112-A1 METHODS AND SYSTEMS FOR RAPID DETECTION OF COVID-19 THE TRUSTEES OF INDIANA UNIVERSITY 2025-04-03 US claimed
US-20250109087-A1 FULL SPECTRUM HEMP OIL COMPOSITIONS CHEMTOR L P (US) 2025-04-03 US claimed
CN-119703056-A Semiconductor slurry suitable for low-temperature sintering and manufacturing method thereof 昆山市诺菲尔电子科技有限公司 2025-03-28 CN claimed
CN-119680527-A Application of supported alkali metal hydride as catalyst for hydrogenation dealkylation of aromatic hydrocarbon 甬江实验室 2025-03-25 CN claimed
CN-119677765-A Method for producing antibiotic macrocyclic peptides 豪夫迈·罗氏有限公司 2025-03-21 CN claimed
CN-119656046-A Pet tooth-cleaning gel and preparation process thereof 江苏雅博动物健康科技有限责任公司 2025-03-21 CN claimed
CN-119638546-A Method for synthesizing isopropyl toluene from toluene and propylene 中国科学院大连化学物理研究所 2025-03-18 CN claimed
EP-0105698-B1 A PROCESS FOR SEPARATING ETHYLBENZENE FROM FEEDSTREAM CONTAINING META-XYLENE USING A ZEOLITE ADSORBENT EXXON RESEARCH AND ENGINEERING COMPANY (US) 1987-03-18 EP claimed
US-4487984-A ALKYLATING BENZENE OR TOLUENE WITH HYDROGEN AND CARBON MONOXIDE; CATALYST COMPOSITE OF OXIDES AND A ZEOLITE UOP INC. (US) 1984-12-11 US claimed
EP-0125230-A1 Dehydrogenation process COSDEN TECHNOLOGY, INC. (US) 1984-11-14 EP claimed
US-4293720-A OXIDATION, BASIC OXIDATION CATALYSTS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1981-10-06 US claimed
US-4181811-A USING A CRYSTALLINE ALUMINA-SILICA ZEOLITE CATALYST TO PRODUCE 1,2 OR 1,3-ISOMERS MOBIL OIL CORPORATION (US) 1980-01-01 US claimed
US-4163863-A PEROXIDATION OF AN ALKYLBENZENE, ACID CATALYZED DECOMPOSITION OF PEROXIDE, CATALYTIC HYDROGENATION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1979-08-07 US claimed
US-4136123-A ALKALI METAL SULFONATE DERIVATIVES THE GOODYEAR TIRE & RUBBER COMPANY (US) 1979-01-23 US claimed
US-3985819-A ALUMINUM CHLORIDE COMPLEX CATALYST; ALKYLATING NAPHTHALENE WITH AN OLEFIN SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-10-12 US claimed
US-3969420-A Process for recovering resorcinol and hydroquinone in mixture SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-07-13 US claimed
US-3952037-A Aluminum catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-04-20 US claimed