SCHEMBL58206

SCHEMBL58206

C[CH]OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
IDO1 P14902 1/20 0.48
AGXT P21549 1/20 0.46
ALDH1A1 P00352 4/20 0.45
MAPK1 P28482 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TP53 P04637 1/20 0.42
TRPA1 O75762 1/20 0.42
MAOB P27338 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
PTGS1 P23219 1/20 0.40
SLC6A2 P23975 1/20 0.40
CYP2C19 P33261 1/20 0.40
PTGS2 P35354 1/20 0.40

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
SCHEMBL9813951 0.83 LTA4H (0.52) TSHR
SCHEMBL201538 0.81 TSHR (0.48) TSHRIDO1AGXTALDH1A1MAPK1
SCHEMBL201537 0.81 TSHR (0.48) TSHRIDO1AGXTALDH1A1MAPK1
SCHEMBL6731394 0.81 TSHR (0.48) TSHRIDO1AGXTALDH1A1MAPK1
SCHEMBL666545 0.79 TSHR (0.57) TSHRIDO1AGXTALDH1A1MAPK1
SCHEMBL27509183 0.79 TSHR (0.57) TSHRIDO1AGXTALDH1A1MAPK1
SCHEMBL6873209 0.77 TSHR (0.55) TSHRIDO1AGXTALDH1A1MAPK1
SCHEMBL450596 0.76 CA1 (0.44) IDO1ALDH1A1TDP1CA1CA2
SCHEMBL114175 0.76 TSHR (0.48) TSHRIDO1AGXTALDH1A1MAPK1
SCHEMBL444754 0.76 LOXL2 (0.41) ALDH1A1CYP1A2CYP2C19

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 2558 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324729-A Synthesis method of 3-alkenyl benzofuran compound 青岛科技大学 2024-07-12 CN claimed
CN-113382988-B Microbiocidal 2-acylamino-thiazole-4-carboxamide derivatives 先正达农作物保护股份公司 2024-06-18 CN claimed
CN-117624029-A Arylpyridine or arylpiperidine derivative or salt thereof, synthesis and application and medicine 赣江中药创新中心 2024-03-01 CN claimed
US-20230398529-A1 ASYMMETRIC TRANSFER HYDROGENATION OF 2-ARYL SUBSTITUTED BICYCLIC PYRIDINE KETONES IN PRESENCE OF A CHIRAL RUTHENIUM CATALYST BAYER AKTIENGESELLSCHAFT (DE) 2023-12-14 US claimed
CN-117164492-A Organic semiconductor g-C 3 N 4 Method for catalytic synthesis of (E) -vinyl selenone compound 化学与精细化工广东省实验室 2023-12-05 CN claimed
EP-4263541-A1 NEW ARYL-PYRIDO-PYRIMIDIN-ONE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2023-10-25 EP claimed
US-20230322776-A1 NEW ARYL-PYRIDO-PYRIMIDIN-ONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-10-12 US claimed
CN-116710451-A Novel aryl-pyrido-pyrimidin-one derivatives 豪夫迈·罗氏有限公司 2023-09-05 CN claimed
WO-2023164238-A1 PROTEASE INHIBITORS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2023-08-31 WO claimed
EP-4229040-A1 ASYMMETRIC TRANSFER HYDROGENATION OF 2-ARYL SUBSTITUTED BICYCLIC PYRIDINE KETONES IN PRESENCE OF A CHIRAL RUTHENIUM CATALYST Bayer Aktiengesellschaft (DE) 2023-08-23 EP claimed
EP-0126974-A1 Carboxyalkyl peptide derivatives G.D. Searle & Co. (US) 1984-12-05 EP claimed
EP-0122482-A1 Monoazo dyestuffs for polyester fibers RESEARCH ASSOCIATION OF SYNTHETIC DYESTUFFS (JP) 1984-10-24 EP claimed
EP-0121875-A2 Process for producing alkaline dischargeable dyeings and prints BASF Aktiengesellschaft (DE) 1984-10-17 EP claimed
EP-0110073-A1 Process for the preparation of tetrahydropyridines BAYER AG (DE) 1984-06-13 EP claimed
EP-0093010-A2 Alpha-hydroxyethylphosphinates, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-11-02 EP claimed
US-4341700-A Monoazo compounds having a substituted 1,2,3-triazolyl-5 diazo component radical and an unsubstituted or substituted 1,4-phenylene coupling component radical SANDOZ LTD. (CH) 1982-07-27 US claimed
US-4178387-A ADMINISTERING AMIDINOUREAS WILLIAM H. RORER, INC. (US) 1979-12-11 US claimed
US-4147804-A ANTIARRHYTHMIA AGENTS WILLIAM H. RORER, INC. (US) 1979-04-03 US claimed
US-4015012-A ANTHELMINTICS BAYER AKTIENGESELLSCHAFT (DT) 1977-03-29 US claimed
US-3970699-A 4-Acylaminophenylacetamidines and a method for their preparation BAYER AKTIENGESELLSCHAFT (DT) 1976-07-20 US claimed