SCHEMBL58197

SCHEMBL58197

CCCCCc1cc[c]cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.54
ADRA2A P08913 2/20 0.54
ADORA3 P0DMS8 2/20 0.54
TACR2 P21452 2/20 0.54
SLC6A2 P23975 2/20 0.54
SLC6A4 P31645 2/20 0.54
SLC6A3 Q01959 2/20 0.54
HSD17B10 Q99714 2/20 0.54
ALDH1A1 P00352 2/20 0.54
CYP3A4 P08684 2/20 0.54
PTGS2 P35354 2/20 0.54
KDM4E B2RXH2 1/20 0.54
LMNA P02545 1/20 0.54
SHBG P04278 1/20 0.54
TP53 P04637 1/20 0.54
HSPD1 P10809 1/20 0.54
ADRB3 P13945 1/20 0.54
HTR2C P28335 1/20 0.54
HSPE1 P61604 1/20 0.54
HIF1A Q16665 1/20 0.54

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
SCHEMBL152118 0.98 PTGS2 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL173702 0.98 PTGS2 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL3673116 0.98 PTGS2 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL151724 0.98 PTGS2 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL225807 0.98 PTGS2 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL2962583 0.98 PTGS2 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL2967935 0.98 PTGS2 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL258640 0.98 PTGS2 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL1610040 0.98 PTGS2 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL2972399 0.98 PTGS2 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2

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 8714 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3389783-B1 NOVEL COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2024-07-03 EP claimed
CN-115368422-B 4', 11-O- (1, 2, 3-triazole) clarithromycin derivatives, and preparation method and application thereof 河南省人民医院 2024-06-28 CN claimed
WO-2024094125-A1 LIPID COMPOUNDS, LIPID NANOPARTICLES, AND PHARMACEUTICAL COMPOSITIONS Shanghai Circode Biomed Co., Ltd. (CN) 2024-05-10 WO claimed
EP-3753941-B1 PYRIMIDINE-FUSED CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SHANGHAI BLUERAY BIOPHARMA CO LTD (CN) 2024-05-01 EP claimed
US-11958871-B2 Inhibitors of bacterial glutaminyl cyclases for use in the treatment of periodontal and related diseases Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2024-04-16 US claimed
CN-117658772-A Alcohol compound and method for hydrogenating ester compound 鲁东大学 2024-03-08 CN claimed
EP-4087889-B1 STABLE MASS POLYMERIZABLE POLYCYCLOOLEFIN COMPOSITIONS AS 3D PRINTING MATERIALS AND A METHOD OF FABRICATION THEREOF PROMERUS LLC (US) 2024-03-06 EP claimed
CN-115928264-B Preparation method of continuous silicon carbide fiber containing metal in near-stoichiometric ratio 湖南泽睿新材料有限公司 2024-02-20 CN claimed
CN-115368341-B Oxime sulfonate compound, resist composition containing oxime sulfonate compound, electronic device and application of oxime sulfonate compound 常州强力先端电子材料有限公司 2024-01-26 CN claimed
CN-115368340-B Oxime sulfonate photoacid generator, resist composition containing oxime sulfonate photoacid generator, electronic device and application of oxime sulfonate photoacid generator 常州强力先端电子材料有限公司 2024-01-26 CN claimed
EP-0052330-A1 Novel resin composition, coating material comprising said resin composition and method for forming coatings Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-05-26 EP claimed
US-4324648-A TO PERMIT REGENERATION OF CATALYST BY OXIDATION PHILLIPS PETROLEUM COMPANY (US) 1982-04-13 US claimed
US-4312773-A WIDE IN MESOMORPHIC RANGE, HIGHLY REDLIABLE SHARP KABUSHIKI KAISHA (JP) 1982-01-26 US claimed
EP-0036661-A1 Process for improving the properties of a cracking catalyst PHILLIPS PETROLEUM COMPANY (US) 1981-09-30 EP claimed
US-4271002-A Calcium ion-selective electrodes and membrane for use therein BECKMAN INSTRUMENTS, INC. (US) 1981-06-02 US claimed
EP-0021626-A1 Salts of phosphoric acid diesters, their preparation and use in membranes, the membranes and their use in calcium ion determination, and the electrodes containing them BECKMAN INSTRUMENTS, INC. (US) 1981-01-07 EP claimed
US-4133648-A ALKANEDIOLS GULF RESEARCH & DEVELOPMENT COMPANY (US) 1979-01-09 US claimed
US-4024277-A INSECTICIDE AND PESTICIDE FMC CORPORATION (US) 1977-05-17 US claimed
US-4022962-A DENTAL PLAQUE INHIBITORS COOPER LABORATORIES, INC. (US) 1977-05-10 US claimed
US-4001137-A Nematic compounds and mixtures MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1977-01-04 US claimed