SCHEMBL4696938

SCHEMBL4696938

O=C(O)c1ccc(C(=O)N2CCOCC2)cc1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.72
PHGDH O43175 1/20 0.71
TSHR P16473 1/20 0.67
AKR1C3 P42330 1/20 0.63
ALDH1A1 P00352 2/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
MAPK1 P28482 1/20 0.61
KDM4E B2RXH2 1/20 0.61
MAPT P10636 1/20 0.61
HTT P42858 1/20 0.61
POLB P06746 1/20 0.60
DNMT1 P26358 1/20 0.60
PTPN7 P35236 1/20 0.60
KMT2A Q03164 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
PKM P14618 1/20 0.60
MLYCD O95822 1/20 0.59
EPHX2 P34913 1/20 0.56

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
SCHEMBL7964773 0.93 TSHR (0.79) HPGDPHGDHTSHRAKR1C3ALDH1A1
SCHEMBL10720943 0.92 PHGDH (0.81) HPGDPHGDHTSHRAKR1C3ALDH1A1
SCHEMBL28296651 0.86 HPGD (0.86) HPGDPHGDHTSHRAKR1C3ALDH1A1
SCHEMBL946143 0.86 HPGD (0.86) HPGDPHGDHTSHRAKR1C3ALDH1A1
SCHEMBL9133746 0.86 ALDH1A1 (0.64) HPGDTSHRALDH1A1SMN1; SMN2MAPK1
Ammonia Solution, Strong SCHEMBL6028542 0.85 HPGD (0.83) HPGDPHGDHTSHRAKR1C3ALDH1A1
SCHEMBL2199279 0.85 PHGDH (0.71) HPGDPHGDHTSHRAKR1C3ALDH1A1
SCHEMBL30449295 0.85 HPGD (0.83) HPGDPHGDHTSHRAKR1C3ALDH1A1
SCHEMBL27045664 0.84 HPGD (1.00) HPGDPHGDHTSHRAKR1C3ALDH1A1
SCHEMBL8150805 0.84 HPGD (0.76) HPGDPHGDHTSHRALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3684775-B1 SUBSTITUTED DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION THERAPEUTICS AS (DK) 2024-11-20 EP claimed
CN-110088108-B Substituted pyrazoloazepin-4-ones and their use as phosphodiesterase inhibitors 联合疗法公司 2024-06-14 CN claimed
EP-3551633-B1 SUBSTITUTED PYRAZOLOAZEPIN-4-ONES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA AS (DK) 2021-03-31 EP claimed
CN-111108109-A Substituted dihydrothienopyrimidines and their use as phosphodiesterase inhibitors 利奥制药有限公司 2020-05-05 CN claimed
CN-110099905-A SUBSTITUTED PYRAZOLOAZEPIN-8-ONES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS 利奥制药有限公司 2019-08-06 CN claimed
CN-110088108-A SUBSTITUTED PYRAZOLOAZEPIN-4-ONES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS 利奥制药有限公司 2019-08-02 CN claimed
US-12403137-B2 Compounds and methods of use TANGO THERAPEUTICS, INC. (US) 2025-09-02 US disclosed
CN-110088108-B Substituted pyrazoloazepin-4-ones and their use as phosphodiesterase inhibitors 联合疗法公司 2024-06-14 CN disclosed
US-20230062119-A1 USE OF BIOMARKERS IN IDENTIFYING PATIENTS THAT WILL BE RESPONSIVE TO TREATMENT WITH A PRMT5 INHIBITOR MERCK SHARP & DOHME LLC (US) 2023-03-02 US disclosed
US-20230062119-A1 USE OF BIOMARKERS IN IDENTIFYING PATIENTS THAT WILL BE RESPONSIVE TO TREATMENT WITH A PRMT5 INHIBITOR MERCK SHARP & DOHME LLC (US) 2023-03-02 US disclosed
US-20230054084-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2023-02-23 US disclosed
US-20230054084-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2023-02-23 US disclosed
EP-3596073-B1 TRICYCLIC COMPOUNDS FOR USE IN TREATMENT OF PROLIFERATIVE DISORDERS. ARGONAUT THERAPEUTICS LTD (GB) 2022-05-11 EP disclosed
CN-1149877-A Novel elastase inhibitors HOECHST MARION ROUSSEL INC (US) 1997-05-14 CN disclosed
CN-1149876-A Perfluoroalkyl ketone inhibitors of elastase and methods of making the same MERRELL PHARMA INC (US) 1997-05-14 CN disclosed
EP-0763055-A1 PERFLUOROALKYL KETONE INHIBITORS OF ELASTASE AND PROCESSES FOR MAKING THE SAME MERRELL PHARMACEUTICALS INC. (US) 1997-03-19 EP disclosed
EP-0762887-A1 ACYLATED ENOL DERIVATIVES AS PRODRUGS OF ELASTASE INHIBITORS MERRELL PHARMACEUTICALS INC. (US) 1997-03-19 EP disclosed
WO-1995033763-A1 NOVEL ELASTASE INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1995-12-14 WO disclosed
WO-1995033762-A1 PERFLUOROALKYL KETONE INHIBITORS OF ELASTASE AND PROCESSES FOR MAKING THE SAME MERRELL PHARMACEUTICALS INC. (US) 1995-12-14 WO disclosed
WO-1995033478-A1 ACYLATED ENOL DERIVATIVES AS PRODRUGS OF ELASTASE INHIBITORS MERRELL PHARMACEUTICALS INC. (US) 1995-12-14 WO 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 (2 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-12403137-B2 Compounds and methods of use XDH, LPXN, F12 HPGD 1064/4885PHGDH 3308/4885TSHR 2040/4885
US-20230054084-A1 COMPOUNDS AND METHODS OF USE XDH, LPXN, F12 HPGD 1064/4885PHGDH 3308/4885TSHR 2040/4885

“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.