SCHEMBL29333

SCHEMBL29333

C=CCN(CCCCC)C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 3/20 0.45
ZDHHC2 Q9UIJ5 2/20 0.45
ALDH1A1 P00352 1/20 0.42
FAAH O00519 2/20 0.40
CA12 O43570 3/20 0.38
CA1 P00915 3/20 0.38
CA9 Q16790 3/20 0.38
CA2 P00918 1/20 0.37
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP8 P22894 1/20 0.36
TSHR P16473 2/20 0.36
MEN1 O00255 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
SOAT1 P35610 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL11085445 0.98 ZDHHC20 (0.47) ZDHHC20ZDHHC2ALDH1A1FAAHCA12
SCHEMBL2159389 0.83 ZDHHC20 (0.46) ZDHHC20ZDHHC2ALDH1A1FAAHCA12
SCHEMBL2159395 0.83 ZDHHC20 (0.46) ZDHHC20ZDHHC2ALDH1A1FAAHCA12
SCHEMBL2362353 0.83 ZDHHC20 (0.46) ZDHHC20ZDHHC2ALDH1A1FAAHCA12
SCHEMBL293960 0.82 CA12 (0.48) ZDHHC20ZDHHC2FAAHCA12CA1
SCHEMBL7596175 0.82 ALDH1A1 (0.48) ALDH1A1TSHRMEN1KMT2ADPP4
SCHEMBL6252070 0.81 GRIN2D (0.41) ZDHHC20ZDHHC2ALDH1A1FAAHCA12
SCHEMBL3259264 0.81 ZDHHC20 (0.45) ZDHHC20ZDHHC2ALDH1A1FAAHCA12
SCHEMBL1076719 0.81 ZDHHC20 (0.61) ZDHHC20ZDHHC2ALDH1A1FAAHCA12
SCHEMBL8033183 0.81 ALDH1A1 (0.47) ZDHHC20ZDHHC2ALDH1A1FAAHCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024026273-A1 THERAPY FOR REDUCED OTOTOXICITY FROM CHEMOTHERAPEUTIC AGENT WITH PENTAAZA MACROCYCLIC RING COMPLEX GALERA LABS, LLC (US) 2024-02-01 WO claimed
US-20230218633-A1 METHODS OF TREATING ORAL MUCOSITIS GALERA LABS, LLC 2023-07-13 US claimed
US-20230158042-A1 COMBINATION CANCER THERAPY WITH PENTAAZA MACROCYCLIC RING COMPLEX AND HORMONE THERAPY AGENT BIOSSIL INC. (CA) 2023-05-25 US claimed
US-20230149358-A1 COMBINATION CANCER THERAPY WITH PENTAAZA MACROCYCLIC RING COMPLEX AND HORMONE THERAPY AGENT BIOSSIL INC. (CA) 2023-05-18 US claimed
EP-4157242-A1 COMBINATION CANCER THERAPY WITH PENTAAZA MACROCYCLIC RING COMPLEX AND HORMONE THERAPY AGENT Galera Labs, LLC (US) 2023-04-05 EP claimed
US-11612608-B2 Methods of treating oral mucositis GALERA LABS, LLC (US) 2023-03-28 US claimed
WO-2023009500-A1 PENTAAZA MACROCYCLIC RING COMPLEX FOR ENHANCED SURGICAL TREATMENT GALERA LABS, LLC (US) 2023-02-02 WO claimed
US-20220227798-A1 MANUFACTURE METHOD FOR AQUEOUS FORMULATION OF MANGANESE-CONTAINING COORDINATION COMPLEX, FORMULATION, AND METHOD OF TREATMENT GALERA LABS, LLC 2022-07-21 US claimed
US-20220118119-A1 COMBINATION CANCER IMMUNOTHERAPY WITH PENTAAZA MACROCYCLIC RING COMPLEX BIOSSIL INC. (CA) 2022-04-21 US claimed
US-20210361701-A1 PENTAAZA MACROCYCLIC RING COMPLEXES FOR LOCAL DELIVERY GALERA LABS, LLC 2021-11-25 US claimed
EP-0679155-A1 MANGANESE COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS EFFECTIVE AS CATALYSTS FOR DISMUTATING SUPEROXIDE. MONSANTO CO (US) 1995-11-02 EP claimed
WO-1994015925-A1 MANGANESE COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS EFFECTIVE AS CATALYSTS FOR DISMUTATING SUPEROXIDE MONSANTO COMPANY (US) 1994-07-21 WO claimed
EP-0298742-B1 Latent cure accelerators for cyanate esters AMOCO CORP (US) 1994-06-01 EP claimed
EP-0598753-A1 MANGANESE COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS EFFECTIVE AS CATALYSTS FOR DISMUTATING SUPEROXIDE MONSANTO COMPANY (US) 1994-06-01 EP claimed
WO-1993002090-A1 MANGANESE COMPLEXES OF NITROGEN-CONTAINING MACROCYCLIC LIGANDS EFFECTIVE AS CATALYSTS FOR DISMUTATING SUPEROXIDE MONSANTO COMPANY (US) 1993-02-04 WO claimed
EP-0524161-A1 Manganese complexes of nitrogen containing macrocyclic ligands effective as catalysts for dismutating superoxide MONSANTO COMPANY (US) 1993-01-20 EP claimed
US-4931496-A Damage tolerant fiber-reinforced composites based on cyanate ester/urea thermosetting composition AMOCO CORPORATION (US) 1990-06-05 US claimed
US-4918157-A COATINGS, ADHESIVES; STORAGE STABLE AMOCO CORPORATION (US) 1990-04-17 US claimed
US-4804740-A STORAGE STABILITY AMOCO CORPORATION (US) 1989-02-14 US claimed
EP-0298742-A2 Latent cure accelerators for cyanate esters AMOCO CORPORATION (US) 1989-01-11 EP claimed

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

For each of this compound's patents that has machine-readable text (7 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-20210361701-A1 PENTAAZA MACROCYCLIC RING COMPLEXES FOR LOCAL DELIVERY SI, APC, VIP ZDHHC20 3969/4885ZDHHC2 3443/4885ALDH1A1 2560/4885
US-20230158042-A1 COMBINATION CANCER THERAPY WITH PENTAAZA MACROCYCLIC RING COMPLEX AND HORMONE THERAPY AGENT MC2R, GHRHR, GNRHR ZDHHC20 4029/4885ZDHHC2 3676/4885ALDH1A1 1209/4885
US-20230149358-A1 COMBINATION CANCER THERAPY WITH PENTAAZA MACROCYCLIC RING COMPLEX AND HORMONE THERAPY AGENT HDAC1, HDAC8, SIRT3 ZDHHC20 3443/4885ZDHHC2 2160/4885ALDH1A1 176/4885
US-20220227798-A1 MANUFACTURE METHOD FOR AQUEOUS FORMULATION OF MANGANESE-CONTAINING COORDINATION COMPLEX, FORMULATION, AND METHOD OF TREATMENT SOD1, MSH6, SLC30A6 ZDHHC20 2422/4885ZDHHC2 3559/4885ALDH1A1 4478/4885
US-20230218633-A1 METHODS OF TREATING ORAL MUCOSITIS LPO, SOD3, MPO ZDHHC20 2877/4885ZDHHC2 3396/4885ALDH1A1 664/4885
US-11612608-B2 Methods of treating oral mucositis LPO, SOD3, MPO ZDHHC20 2877/4885ZDHHC2 3396/4885ALDH1A1 664/4885
US-20220118119-A1 COMBINATION CANCER IMMUNOTHERAPY WITH PENTAAZA MACROCYCLIC RING COMPLEX CD274, PDCD1, PDCD1LG2 ZDHHC20 2673/4885ZDHHC2 1685/4885ALDH1A1 1111/4885

“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.