SCHEMBL4458404

SCHEMBL4458404

O=C(NC(c1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.79

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 2/20 0.79
LMNA P02545 4/20 0.61
HPGD P15428 1/20 0.61
ALDH1A1 P00352 8/20 0.61
GAA P10253 3/20 0.61
CYP3A4 P08684 1/20 0.59
CTRB1 P17538 1/20 0.59
RXFP1 Q9HBX9 1/20 0.58
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
SLC6A9 P48067 1/20 0.55
SLC6A5 Q9Y345 1/20 0.55
S1PR3 Q99500 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
SCHEMBL30530170 0.89 SMN1; SMN2 (0.69) HPGDSLMNAHPGDALDH1A1GAA
SCHEMBL30530164 0.89 LMNA (0.68) HPGDSLMNAHPGDALDH1A1GAA
SCHEMBL30530178 0.89 SLC6A9 (0.71) HPGDSLMNAHPGDALDH1A1GAA
SCHEMBL30530179 0.89 ALDH1A1 (0.74) HPGDSLMNAHPGDALDH1A1GAA
SCHEMBL28466273 0.87 SLC6A9 (0.68) HPGDSLMNAGAAMEN1KMT2A
SCHEMBL28466269 0.87 HPGDS (0.72) HPGDSLMNAHPGDALDH1A1GAA
SCHEMBL28472171 0.87 HPGDS (0.72) HPGDSLMNAHPGDALDH1A1GAA
SCHEMBL5521051 0.87 ALDH1A1 (0.76) HPGDSLMNAALDH1A1GAACYP3A4
SCHEMBL11626488 0.87 ALDH1A1 (0.74) HPGDSLMNAALDH1A1CYP3A4RXFP1
SCHEMBL28677383 0.87 LMNA (0.67) HPGDSLMNAALDH1A1GAACYP3A4

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112661584-B Preparation method of photocatalytic N-alkyl amide compound 大连理工大学 2022-08-05 CN claimed
EP-0415413-A1 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-06 EP claimed
CN-122079973-A Fatty nitroamine deamination functionalization process 2026-05-26 CN disclosed
CN-122059947-A Deamination functionalization method of fatty amine 国科大杭州高等研究院 2026-05-19 CN disclosed
CN-117355373-A Ethylene oligomerization process 切弗朗菲利浦化学公司 2024-01-05 CN disclosed
CN-113943199-B Method for synthesizing amide compound by using nitrile and diaryl methane as raw materials 浙江工业大学 2023-09-22 CN disclosed
CN-112661584-B Preparation method of photocatalytic N-alkyl amide compound 大连理工大学 2022-08-05 CN disclosed
CN-113943199-A Method for synthesizing amide compound by taking nitrile and diarylmethane as raw materials 浙江工业大学 2022-01-18 CN disclosed
CN-112661584-A Preparation method of photocatalytic N-alkyl amide compound 大连理工大学 2021-04-16 CN disclosed
CN-107790186-B Novel decamethyl cyclopentadienyl zirconium complex and preparation method and application thereof 山西医科大学 2020-10-30 CN disclosed
CN-106565517-B A method of amide is prepared by arylmethane derivative and nitrile 湖南大学 2018-08-17 CN disclosed
CN-107790186-A A kind of new decamethyl Zirconocenes and its preparation method and application 山西医科大学 2018-03-13 CN disclosed
CN-106565517-A Method for preparing amide from aryl methane derivative and nitrile 湖南大学 2017-04-19 CN disclosed
WO-2009103778-A1 COMPOUNDS AND METHODS NOVASAID AB (SE) 2009-08-27 WO disclosed
WO-2009017838-A2 COMBINATIONS OF JAK-2 INHIBITORS AND OTHER AGENTS EXELIXIS, INC. (US) 2009-02-05 WO disclosed
EP-0415413-A1 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-06 EP disclosed