SCHEMBL437127

SCHEMBL437127

COC(=O)CCCC(C)=O

nearest known ligand 0.79

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.79
MGAM O43451 1/20 0.55
GAA P10253 1/20 0.55
SI P14410 1/20 0.55
MGAM2 Q2M2H8 1/20 0.55
ALDH1A1 P00352 3/20 0.48
LMNA P02545 3/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
GLA P06280 1/20 0.46
CA12 O43570 1/20 0.43
CA14 Q9ULX7 1/20 0.43
KDM4E B2RXH2 1/20 0.43
RECQL P46063 1/20 0.43
ACHE P22303 1/20 0.42
PAOX Q6QHF9 1/20 0.42
HSD17B10 Q99714 2/20 0.42
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL1706595 0.95 TSHR (0.70) TSHRMGAMGAASIMGAM2
SCHEMBL3628963 0.92 TSHR (0.67) TSHRMGAMGAASIMGAM2
SCHEMBL6421942 0.92 TSHR (0.67) TSHRMGAMGAASIMGAM2
SCHEMBL3626724 0.92 TSHR (0.67) TSHRMGAMGAASIMGAM2
SCHEMBL6821595 0.92 TSHR (0.67) TSHRMGAMGAASIMGAM2
SCHEMBL16902770 0.92 TSHR (0.67) TSHRMGAMGAASIMGAM2
SCHEMBL7941508 0.92 TSHR (0.67) TSHRMGAMGAASIMGAM2
SCHEMBL50039 0.89 TSHR (1.00) TSHRMGAMGAASIMGAM2
SCHEMBL11955444 0.88 TSHR (0.61) TSHRMGAMGAASIMGAM2
SCHEMBL20740173 0.86 TSHR (0.65) TSHRMGAMGAASIMGAM2

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

Claimed or disclosed in 272 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118026995-A Dihydrotriazole aromatization precursor and application thereof in deacylating and arylating reaction of ketone 国科大杭州高等研究院 2024-05-14 CN claimed
CN-117986120-A Purification and separation process and equipment for methyl 5-oxo-hexanoate 青岛科技大学 2024-05-07 CN claimed
CN-116143622-A Synthesis method of cyclohexanedione intermediate methyl 5-oxohexanoate 浙江工业大学 2023-05-23 CN claimed
CN-111253834-B Moisture-cured epoxy coating and preparation method thereof 滨州学院 2022-05-24 CN claimed
CN-114380674-B Preparation method of 1, 3-cyclohexanedione 山东智永化工产业技术研究院有限公司 2022-05-20 CN claimed
CN-114394898-A Preparation method of 5-oxohexanoate 山东智永化工产业技术研究院有限公司 2022-04-26 CN claimed
CN-114380674-A Preparation method of 1, 3-cyclohexanedione 山东智永化工产业技术研究院有限公司 2022-04-22 CN claimed
CN-111253834-A Moisture-curing epoxy coating and preparation method thereof 滨州学院 2020-06-09 CN claimed
US-10233337-B2 Charge-transporting varnish NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-03-19 US claimed
CN-107876092-A The high stability titanium catalyst of ester exchange carbonate synthesis benzene methyl and diphenyl carbonate 华东理工大学 2018-04-06 CN claimed
EP-0891364-A1 CALIXPYRROLES, CALIXPYRIDINOPYRROLES AND CALIXPYRIDINES THE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1999-01-20 EP claimed
WO-1997037995-A1 CALIXPYRROLES, CALIXPYRIDINOPYRROLES AND CALIXPYRIDINES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1997-10-16 WO claimed
EP-0123362-B1 PROCESS FOR THE PREPARATION OF 6-METHYLPYRIDONE-2 STAMICARBON B.V. (NL) 1987-08-05 EP claimed
US-4611033-A Process for stabilizing a poly(aryl ether ketone) UNION CARBIDE CORPORATION (US) 1986-09-09 US claimed
US-4599421-A FROM 5-OXOCAPROIC ACID OR DERIVATIVE AND AMMONIA OR AMINE STAMICARBON B.V. (NL) 1986-07-08 US claimed
EP-0123362-A1 Process for the preparation of 6-methylpyridone-2 STAMICARBON B.V. (NL) 1984-10-31 EP claimed
EP-0054166-B1 PROCESS FOR THE PREPARATION OF 5-OXOHEXANOIC ACID ALKYL ESTERS AND OF 5-OXOHEXANE NITRILE HOECHST AKTIENGESELLSCHAFT (DE) 1984-05-09 EP claimed
US-4409400-A CYCLIZATION, CATALYSTS OF GROUP 3 OR 4 METALS HOECHST AKTIENGESELLSCHAFT (DE) 1983-10-11 US claimed
EP-0054166-A1 Process for the preparation of 5-oxohexanoic acid alkyl esters and of 5-oxohexane nitrile HOECHST AKTIENGESELLSCHAFT (DE) 1982-06-23 EP claimed
US-4267362-A Process for the preparation of delta keto-acids and derivatives thereof STAMICARBON, B.V. (NL) 1981-05-12 US claimed