SCHEMBL478613

SCHEMBL478613

CCOC(=O)C(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.61
CES2 O00748 1/20 0.54
MAPT P10636 4/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
MAPK1 P28482 1/20 0.53
ALDH1A1 P00352 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 2/20 0.51
KCNJ1 P48048 1/20 0.51
KCNH2 Q12809 1/20 0.51
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL11838567 0.95 CES1 (0.56) CES1CES2MAPTKMT2AMEN1
SCHEMBL28471711 0.93 KMT2A (0.62) CES1CES2MAPTKMT2AMEN1
SCHEMBL4478597 0.90 CES1 (0.58) CES1CES2MAPTKMT2AMEN1
SCHEMBL9578843 0.88 MAPT (0.63) CES1CES2MAPTKMT2AMEN1
SCHEMBL7977733 0.85 CES1 (0.51) CES1CES2MAPTKMT2AMEN1
SCHEMBL7977731 0.85 CES1 (0.51) CES1CES2MAPTKMT2AMEN1
SCHEMBL2666687 0.85 MAPT (0.46) CES1CES2MAPTKMT2AMEN1
SCHEMBL7699081 0.84 CES1 (0.50) CES1CES2MAPTKMT2AMEN1
SCHEMBL11110090 0.84 MAPK1 (0.54) CES1MAPTKMT2AMEN1MAPK1
SCHEMBL11568780 0.84 MAPT (0.51) CES1MAPTKMT2AMEN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3619214-B1 GAMMA-SPIROKETAL-GAMMA-LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2024-11-06 EP claimed
EP-3630776-B1 FURO[2,3-B]PYRAN-2-ONE COMPOUNDS AND PROCESS FOR PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2023-05-17 EP claimed
US-11339174-B2 γ-spiroketal-γ-lactones and pharmaceutical composition containing same and process for preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2022-05-24 US claimed
US-20210198273-A1 GAMMA-SPIROKETAL-GAMMA-LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-07-01 US claimed
US-10941155-B2 Furo[2,3-b]pyran-2-one compounds and process for preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-03-09 US claimed
US-20200165263-A1 FURO[2,3-b]PYRAN-2-ONE COMPOUNDS AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2020-05-28 US claimed
EP-3619214-A1 GAMMA-SPIROKETAL-GAMMA-LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF Council of Scientific and Industrial Research (IN) 2020-03-11 EP claimed
WO-2018203346-A1 γ-SPIROKETAL- γ –LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2018-11-08 WO claimed
US-12421187-B2 Dihydrofolate synthase (DHFS) inhibiting agents and methods of making and using same WASHINGTON UNIVERISTY (US) 2025-09-23 US disclosed
EP-3619214-B1 GAMMA-SPIROKETAL-GAMMA-LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2024-11-06 EP disclosed
US-20230322667-A1 DIHYDROFOLATE SYNTHASE (DHFS) INHIBITING AGENTS AND METHODS OF MAKING AND USING SAME WASHINGTON UNIVERSITY (US) 2023-10-12 US disclosed
US-20230322667-A1 DIHYDROFOLATE SYNTHASE (DHFS) INHIBITING AGENTS AND METHODS OF MAKING AND USING SAME WASHINGTON UNIVERSITY (US) 2023-10-12 US disclosed
US-20230322667-A1 DIHYDROFOLATE SYNTHASE (DHFS) INHIBITING AGENTS AND METHODS OF MAKING AND USING SAME WASHINGTON UNIVERSITY (US) 2023-10-12 US disclosed
EP-3630776-B1 FURO[2,3-B]PYRAN-2-ONE COMPOUNDS AND PROCESS FOR PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2023-05-17 EP disclosed
EP-0675133-B1 13-Substituted milbemycin derivatives, their preparation and use SANKYO CO (JP) 2000-01-12 EP disclosed
US-5614470-A AGRICULTURAL ANTHELMINTIC, ACARICIDE, INSECTICIDE SANKYO COMPANY, LIMITED (JP) 1997-03-25 US disclosed
CN-1112119-A 13-substituted milbemycin derivatives, their preparation and use SANKYO CO (JP) 1995-11-22 CN disclosed
EP-0675133-A1 13-Substituted milbemycin derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1995-10-04 EP disclosed
EP-0386940-A1 6-Beta-(alpha-etherified oxymino)-acyl amino penicillins BEECHAM GROUP PLC (GB) 1990-09-12 EP disclosed
US-4348399-A Antiatherosclerotic and hypolipidemic 4-(monoalkylamino)phenyl alkane, alkene and alkyne carbinols, aldehydes, carboxylic acids and derivatives AMERICAN CYANAMID COMPANY (US) 1982-09-07 US 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 (6 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-20230322667-A1 DIHYDROFOLATE SYNTHASE (DHFS) INHIBITING AGENTS AND METHODS OF MAKING AND USING SAME DHFR, DHPS, MTHFD1 CES1 408/4885CES2 998/4885MAPT 4436/4885
US-10941155-B2 Furo[2,3-b]pyran-2-one compounds and process for preparation thereof KMO, ALDOA, AKR1C2 CES1 915/4885CES2 3141/4885MAPT 4627/4885
US-11339174-B2 γ-spiroketal-γ-lactones and pharmaceutical composition containing same and process for preparation thereof HSD17B7, PKD1, CYP17A1 CES1 895/4885CES2 3614/4885MAPT 1884/4885
US-20200165263-A1 FURO[2,3-b]PYRAN-2-ONE COMPOUNDS AND PROCESS FOR PREPARATION THEREOF KMO, ALDOA, AKR1C2 CES1 915/4885CES2 3141/4885MAPT 4627/4885
US-20210198273-A1 GAMMA-SPIROKETAL-GAMMA-LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF HSD17B7, PKD1, CYP17A1 CES1 883/4885CES2 3608/4885MAPT 1946/4885
US-12421187-B2 Dihydrofolate synthase (DHFS) inhibiting agents and methods of making and using same DHFR, DHPS, MTHFD1 CES1 408/4885CES2 998/4885MAPT 4436/4885

“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.