SCHEMBL126245

SCHEMBL126245

Nc1ccc2c(c1)OCO2

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.63
KDM4E B2RXH2 1/20 0.63
GAA P10253 1/20 0.63
ALDH1A1 P00352 3/20 0.62
MAPK1 P28482 3/20 0.62
CYP19A1 P11511 2/20 0.62
TAAR1 Q96RJ0 2/20 0.55
CYP3A4 P08684 3/20 0.54
CMA1 P23946 1/20 0.50
SLC6A4 P31645 1/20 0.48
HTR3E A5X5Y0 1/20 0.48
HTR3B O95264 1/20 0.48
HTR3A P46098 1/20 0.48
HTR3D Q70Z44 1/20 0.48
HTR3C Q8WXA8 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ABCG2 Q9UNQ0 1/20 0.48
TRPM8 Q7Z2W7 1/20 0.47
CYP2D6 P10635 1/20 0.47

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
SCHEMBL29465203 1.00 MAPT (0.63) MAPTKDM4EGAAALDH1A1MAPK1
Bromide SCHEMBL5755432 0.98 MAPT (0.61) MAPTKDM4EGAAALDH1A1MAPK1
Methane SCHEMBL14484773 0.98 MAPT (0.61) MAPTKDM4EGAAALDH1A1MAPK1
Hydrochloric Acid SCHEMBL6575835 0.98 MAPT (0.67) MAPTKDM4EGAAALDH1A1MAPK1
SCHEMBL20776840 0.89 MAPT (0.62) MAPTKDM4EGAAALDH1A1MAPK1
Biphenyl SCHEMBL27625903 0.88 ADORA1 (0.55) MAPTKDM4EGAAALDH1A1MAPK1
SCHEMBL159592 0.85 MAPT (0.83) MAPTKDM4EGAAALDH1A1MAPK1
SCHEMBL30197402 0.85 MAPT (0.83) MAPTKDM4EGAAALDH1A1MAPK1
Hydrochloric Acid SCHEMBL2475806 0.83 MAPT (0.88) MAPTKDM4EGAAALDH1A1MAPK1
SCHEMBL1131997 0.83 MAPT (0.80) MAPTKDM4EGAAALDH1A1MAPK1

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 5642 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118126023-B Pyrazole amide compound as well as preparation method and application thereof 安徽中医药大学 2025-04-11 CN claimed
CN-118994183-B Synthesis method of stable isotope labeled oxolinic acid 山东辉璟生物医药科技有限公司 2025-03-11 CN claimed
CN-119241449-A Piperazine derivative and preparation method and application thereof 重庆市畜牧科学院 2025-01-03 CN claimed
CN-115838355-B 1, 4-Disubstituted piperazine-2, 5-dione derivative, preparation method and application thereof 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) 2024-12-03 CN claimed
CN-118994183-A Synthesis method of stable isotope labeled oxolinic acid 山东辉璟生物医药科技有限公司 2024-11-22 CN claimed
CN-118878508-A DC-Rhoin derivative, preparation method and application thereof 广东省中医院(广州中医药大学第二附属医院、广州中医药大学第二临床医学院、广东省中医药科学院) 2024-11-01 CN claimed
CN-118812375-A Method for catalyzing stereoselective ring opening of epoxide by diaryl boric acid 中国科学院大连化学物理研究所 2024-10-22 CN claimed
EP-4444264-A1 COMPOSITION COMPRISING TWO PARTICULAR OXIDATION DYE PRECURSORS AND A PHOSPHORIC SURFACTANT L'OREAL (FR) 2024-10-16 EP claimed
CN-118684621-A Diphenylamine bridged pyridine compound, ruthenium complex, preparation method thereof and application thereof in methylation reaction 河北师范大学 2024-09-24 CN claimed
CN-118126023-A Pyrazole amide compound as well as preparation method and application thereof 安徽中医药大学 2024-06-04 CN claimed
EP-0166155-A1 2-Alkylsulphonyl-1,4-diaminobenzenes, process for their preparation and oxidative hair-dyeing compositions containing these compounds Wella Aktiengesellschaft (DE) 1986-01-02 EP claimed
US-4543425-A 1,3-Diamino-4-(2',2',2',-trifluoroethoxy)-benzene, method of producing the same, and hair coloring composition containing the same WELLA AG (DE) 1985-09-24 US claimed
US-4495351-A FOR UROGENVITAL DISORDERS VEB ARZNEIMITTELWERK DRESDEN (DD) 1985-01-22 US claimed
US-4473375-A COUPLER AND DEVELOPER FOR OXIDATION COLOR DYES WELLA AKTIENGESELLSCHAFT (DE) 1984-09-25 US claimed
EP-0043436-B1 COMPOSITION AND PROCESS FOR DYEING HAIR Wella Aktiengesellschaft (DE) 1983-08-31 EP claimed
WO-1983001771-A1 DERIVATIVES OF 2-HYDROXY-4-AMINO-BENZENE, PREPARATION THEREOF AND HAIR DYE CONTAINING SUCH DERIVATIVES KONRAD, EUGEN 1983-05-26 WO claimed
WO-1982000092-A1 HAIR COLORATION METHOD AND COMPOSITION THEREFOR KONRAD E 1982-01-21 WO claimed
EP-0043436-A1 Composition and process for dyeing hair Wella Aktiengesellschaft (DE) 1982-01-13 EP claimed
EP-0005756-B1 5-ARYLAMINO-2,2-DIFLUORO-BENZODIOXOLANES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS PESTICIDES BAYER AG (DE) 1981-10-14 EP claimed
EP-0005756-A2 5-Arylamino-2,2-difluoro-benzodioxolanes, process for their preparation, and their use as pesticides BAYER AG (DE) 1979-12-12 EP claimed