SCHEMBL805142

SCHEMBL805142

O=C1c2ccccc2C(=O)N1CCNCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OGA O60502 1/20 0.70
HEXA P06865 1/20 0.70
HEXB P07686 1/20 0.70
SIRT1 Q96EB6 3/20 0.64
GLS O94925 1/20 0.59
ACHE P22303 4/20 0.56
TERT O14746 1/20 0.53
NPC1 O15118 1/20 0.52
CASP3 P42574 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
SENP6 Q9GZR1 1/20 0.52

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
SCHEMBL7973833 0.98 OGA (0.68) OGAHEXAHEXBSIRT1GLS
SCHEMBL7476248 0.92 SIRT1 (0.66) OGAHEXAHEXBSIRT1ACHE
SCHEMBL28437687 0.91 HEXA (0.60) OGAHEXAHEXBSIRT1GLS
SCHEMBL3197666 0.91 TERT (0.67) OGAHEXAHEXBSIRT1GLS
Acetic Acid SCHEMBL4521454 0.89 OGA (0.58) OGAHEXAHEXBSIRT1ACHE
SCHEMBL20818051 0.89 ALDH1A1 (0.59) OGAHEXAHEXBSIRT1GLS
SCHEMBL1210939 0.88 OGA (0.57) OGAHEXAHEXBSIRT1GLS
SCHEMBL9218494 0.88 ACHE (0.66) SIRT1ACHE
SCHEMBL10282631 0.88 SIRT1 (0.60) OGAHEXAHEXBSIRT1ACHE
SCHEMBL18730546 0.88 TDP1 (0.61) OGAHEXAHEXBSIRT1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7511035-B2 Antibacterial agents GLAXO GROUP LIMITED (GB) 2009-03-31 US claimed
US-20080139539-A1 Antibacterial Agents GLAXO GROUP LIMITED (GB) 2008-06-12 US claimed
EP-1155023-B1 CHELATING COMPOUNDS AND THEIR COMPLEXES WITH PARAMAGNETIC METALS BRACCO SPA (IT) 2005-03-02 EP claimed
JP-2003518131-A 2003-06-03 JP claimed
US-20030013859-A1 CHELATING COMPOUNDS, THEIR COMPLEXES WITH PARAMAGNETIC METALS BRACCO S.P.A. (IT) 2003-01-16 US claimed
EP-1155023-A1 CHELATING COMPOUNDS AND THEIR COMPLEXES WITH PARAMAGNETIC METALS BRACCO S.p.A. (IT) 2001-11-21 EP claimed
WO-2001046207-A1 CHELATING COMPOUNDS, THEIR COMPLEXES WITH PARAMAGNETIC METALS BRACCO S.P.A. (IT) 2001-06-28 WO claimed
US-11795247-B2 Polyolefin dispersants and methods of making and using thereof THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 2023-10-24 US disclosed
US-20220025254-A1 Complexes and Ligands THE GENERAL HOSPITAL CORPORATION 2022-01-27 US disclosed
WO-2021047139-A1 POLYAMINO SURFACTANT, PREPARATION METHOD THEREFOR AND USE THEREOF 肯特催化材料股份有限公司 2021-03-18 WO disclosed
EP-3229848-B1 TARGETED CONTRAST AGENTS COMPRISING A HYDRAZIDE FUNCTIONAL GROUP RF THERAPEUTICS INC (CA) 2020-08-12 EP disclosed
US-10286090-B2 Targeted contrast agents comprising a hydrazide functional group RF THERAPEUTICS INC. (CA) 2019-05-14 US disclosed
US-10286090-B2 Targeted contrast agents comprising a hydrazide functional group RF THERAPEUTICS INC. (CA) 2019-05-14 US disclosed
WO-1989012631-A1 MACROCYCLIC BIFUNCTIONAL CHELANTS, COMPLEXES THEREOF AND THEIR ANTIBODY CONJUGATES THE DOW CHEMICAL COMPANY (US) 1989-12-28 WO disclosed
US-4837003-A RADIONUCLIDE-ANTIBODY CHELATE COMPLEX; TUMOR DIAGNOSIS MALLINCKRODT, INC. (US) 1989-06-06 US disclosed
US-4659839-A MALEIMIDE AND CHELATING MOIETY MALLINCKRODT, INC. (US) 1987-04-21 US disclosed
EP-0194750-A1 Dihydropyridine alkanol amines, process for their preparation and pharmaceutical compositions containing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-09-17 EP disclosed
WO-1986004581-A1 DIHYDROPYRIDINE ALKANOLAMINES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-08-14 WO disclosed
EP-0178125-A2 Labeled antibody fragments. Mallinckrodt, Inc. (a Delaware corporation) (US) 1986-04-16 EP disclosed
EP-0174853-A2 Radiolabeled antibody fragments Mallinckrodt, Inc. (a Delaware corporation) (US) 1986-03-19 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10286090-B2 Targeted contrast agents comprising a hydrazide functional group ANTXR2, CA4, CA14 OGA 1049/4885HEXA 325/4885HEXB 419/4885
US-20080139539-A1 Antibacterial Agents NQO2, NQO1, NRDC OGA 2721/4885HEXA 1349/4885HEXB 2133/4885
US-20220025254-A1 Complexes and Ligands BID, CLTB, NECTIN4 OGA 1829/4885HEXA 2320/4885HEXB 1628/4885
US-20030013859-A1 CHELATING COMPOUNDS, THEIR COMPLEXES WITH PARAMAGNETIC METALS MPI, SLC39A14, LRPPRC OGA 2648/4885HEXA 2812/4885HEXB 3043/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.