Pentanal

Pentanal

SCHEMBL3395615

CCCCC=O.O.[Nb]

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

The experimentally established mechanism targets of Pentanal. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Pentanal SCHEMBL5378831 0.97
Pentanal SCHEMBL24385 0.97
Pentanal SCHEMBL10415727 0.97 TSHR (0.93)
Pentanal SCHEMBL7803290 0.94
Pentanal SCHEMBL3391299 0.94
Pentanal SCHEMBL7160193 0.94
Pentanal SCHEMBL9394562 0.94 TSHR (0.88)
Pentanal SCHEMBL28721 0.94
Pentanal SCHEMBL622584 0.94 TSHR (1.00)
Pentanal SCHEMBL7624050 0.90

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240149253-A1 LARGE SCALE SYNTHESIS OF OXIDATIVE DEHYDROGENATION CATALYST NOVA CHEMICALS (INTERNATIONAL) S.A. (CH) 2024-05-09 US claimed
EP-4297896-A1 LARGE SCALE SYNTHESIS OF OXIDATIVE DEHYDROGENATION CATALYST Nova Chemicals (International) S.A. (CH) 2024-01-03 EP claimed
CN-116997412-A Large-scale synthesis of oxidative dehydrogenation catalysts 诺瓦化学品(国际)股份有限公司 2023-11-03 CN claimed
CN-115920877-A Polyacid coupling multifunctional solid acid catalyst and preparation method and application thereof 南京工业大学 2023-04-07 CN claimed
WO-2022180475-A1 LARGE SCALE SYNTHESIS OF OXIDATIVE DEHYDROGENATION CATALYST NOVA CHEMICALS (INTERNATIONAL) S.A. (CH) 2022-09-01 WO claimed
CN-110302815-B Ag @ SiO2Synthesis method of supported mesoporous niobium phosphate catalyst and application of supported mesoporous niobium phosphate catalyst in preparation of 5-hydroxymethylfurfural 广西科技大学鹿山学院 2021-11-09 CN claimed
CN-110302816-B ZnO@SiO2Synthesis method of supported mesoporous niobium phosphate catalyst and application of supported mesoporous niobium phosphate catalyst in preparation of 5-hydroxymethylfurfural 广西科技大学鹿山学院 2021-11-09 CN claimed
EP-4680388-A1 CATALYSTS FOR OXIDATIVE DEHYDROGENATION Nova Chemicals (International) S.A. (CH) 2026-01-21 EP disclosed
EP-4680387-A1 MAKING CATALYSTS FOR OXIDATIVE DEHYDROGENATION Nova Chemicals (International) S.A. (CH) 2026-01-21 EP disclosed
EP-4626829-A1 METHOD FOR TREATING POSITIVE ELECTRODE ACTIVE MATERIAL PARTICLES, AND POSITIVE ELECTRODE ACTIVE MATERIAL AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY EMPLOYING SAME BASF SE (DE) 2025-10-08 EP disclosed
US-20250059060-A1 HIGH TEMPERATURE-PHASE NIOBIUM PENTOXIDE (H-NB2O5) BASED ELECTRODES FOR HIGH-POWER LITHIUM-ION (US NP) GEORGIA TECH RESEARCH CORPORATION 2025-02-20 US disclosed
WO-2024189533-A1 MAKING CATALYSTS FOR OXIDATIVE DEHYDROGENATION NOVA CHEMICALS (INTERNATIONAL) S.A. (CH) 2024-09-19 WO disclosed
WO-2024189534-A1 CATALYSTS FOR OXIDATIVE DEHYDROGENATION NOVA CHEMICALS (INTERNATIONAL) S.A. (CH) 2024-09-19 WO disclosed
US-5667695-A Process for removing contaminant metal ions from liquid streams using metallo germanate molecular sieves UOP (US) 1997-09-16 US disclosed
WO-1997013724-A1 NIOBIUM AND TANTALUM PENTOXIDE COMPOUNDS CABOT CORPORATION (US) 1997-04-17 WO disclosed
US-5371294-A Reacting phenol with aniline or ammonia using hydrogenation catalyst of palladium supported on niobic or tantalic acid BAYER AKTIENGESELLSCHAFT (DE) 1994-12-06 US disclosed
US-5322965-A Hydrogenation of optionally substituted aniline with palladium and ruthenium on niobic acid support BAYER AKTIENGESELLSCHAFT (DE) 1994-06-21 US disclosed
EP-0287840-B1 Process for producing polyesters using a niobium compound as a catalyst KANEBO LTD (JP) 1994-02-02 EP disclosed
US-4818808-A HEAT TREATED, HYDRATED NIOBIC ACID CATALYST KANEBO, LTD. (JP) 1989-04-04 US disclosed
EP-0287840-A2 Process for producing polyesters using a niobium compound as a catalyst KANEBO, LTD. (JP) 1988-10-26 EP disclosed