SCHEMBL355378

SCHEMBL355378

O=C(O)c1c(F)cccc1[N+](=O)[O-]

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
TSHR P16473 1/20 0.50
GPR35 Q9HC97 3/20 0.48
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
APEX1 P27695 1/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CASP6 P55212 2/20 0.42
POLB P06746 1/20 0.42
DNA2 P51530 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41

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
SCHEMBL17819747 1.00 TDP1 (0.64) TDP1L3MBTL1TSHRGPR35CES2
SCHEMBL1554602 0.86 TDP1 (0.75) TDP1L3MBTL1TSHRGPR35APEX1
SCHEMBL4688384 0.84 TDP1 (0.50) TDP1L3MBTL1TSHRGPR35CES2
SCHEMBL25176225 0.84 TDP1 (0.53) TDP1L3MBTL1TSHRGPR35CES2
SCHEMBL16108925 0.84 TDP1 (0.49) TDP1L3MBTL1TSHRGPR35CES2
SCHEMBL16044470 0.84 TDP1 (0.53) TDP1L3MBTL1TSHRGPR35CES2
SCHEMBL793112 0.84 TDP1 (0.49) TDP1L3MBTL1TSHRGPR35CES2
SCHEMBL21749965 0.83 TDP1 (0.51) TDP1L3MBTL1TSHRCA1CA2
Hydrogen Sulfide SCHEMBL28004578 0.82 TDP1 (0.70) TDP1L3MBTL1TSHRGPR35APEX1
SCHEMBL21248524 0.81 MAPK1 (0.54) TDP1L3MBTL1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
EP-3943494-A1 QUINAZOLINONES AS INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2022-01-26 EP claimed
US-10906907-B2 Tert-butyl (s)-(1-(5-fluoro-4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)propyl)carbamate precursor of a quinazolinone inhibitor of human phosphatidylinositol 3-kinase delta and a process for preparing thereof ICOS CORPORATION (US) 2021-02-02 US claimed
WO-2017191608-A1 NOVEL PROCESS FOR PREPARATION OF IDELALISIB LAURUS LABS LIMITED (IN) 2017-11-09 WO claimed
WO-2016108206-A2 PROCESSES FOR PREPARATION OF IDELALISIB AND INTERMEDIATES THEREOF DR. REDDY’S LABORATORIES LIMITED (IN) 2016-07-07 WO claimed
US-12630516-B2 Compounds NRG THERAPEUTICS LTD. (GB) 2026-05-19 US disclosed
EP-4208442-B1 MPTP INHIBITORS NRG THERAPEUTICS LTD (GB) 2025-10-22 EP disclosed
CN-120117999-A Fluorotranilast derivatives and medical application thereof 中国药科大学 2025-06-10 CN disclosed
US-20250179028-A1 ACRYLAMIDE COMPOUNDS NRG THERAPEUTICS LTD (GB) 2025-06-05 US disclosed
US-12221448-B2 Selective PI3Kδ inhibitor and use thereof Tarapeutics Science Inc. (CN) 2025-02-11 US disclosed
EP-4486721-A1 ACRYLAMIDE COMPOUNDS NRG Therapeutics LTD (GB) 2025-01-08 EP disclosed
US-20240360085-A1 Glucose Uptake Inhibitors KADMON CORPORATION, LLC (US) 2024-10-31 US disclosed
US-4346034-A Process for preparing imidazodiazepines HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346032-A ANTIDOTES TO OVERDOSES OF BENZODIAZEPINE TRANQUILIZERS HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346030-A ANTIDOTES FOR OVERDOSES OF BENZODIAZEPINE TRANQUILIZERS HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346031-A Process for preparing imidazodiazepines HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346035-A Process for preparing imidazodiazepines HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346036-A ALKYLATION; AMIDATION; TRANQUILIZER ANTAGONIST HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4316839-A Imidazodiazepine derivatives HOFFMAN-LA ROCHE INC. (US) 1982-02-23 US disclosed
EP-0027214-A1 Imidazodiazepine derivatives, process and intermediates for their preparation, medicaments containing them and their therapeutic application F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1981-04-22 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 (5 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-12630516-B2 Compounds CYP4B1, CYP1B1, NR4A1 TDP1 3531/4885L3MBTL1 3747/4885TSHR 1589/4885
US-20250179028-A1 ACRYLAMIDE COMPOUNDS ACR, CCNI, FANCI TDP1 607/4885L3MBTL1 3937/4885TSHR 4232/4885
US-20240360085-A1 Glucose Uptake Inhibitors SLC2A3, SLC2A1, SLC2A4 TDP1 3799/4885L3MBTL1 3239/4885TSHR 2854/4885
US-12221448-B2 Selective PI3Kδ inhibitor and use thereof PIK3CA, PIK3CD, PIK3R2 TDP1 1289/4885L3MBTL1 2308/4885TSHR 1925/4885
US-10906907-B2 Tert-butyl (s)-(1-(5-fluoro-4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)propyl)carbamate precursor of a quinazolinone inhibitor of human phosphatidylinositol 3-kinase delta and a process for preparing thereof PIK3CD, PIK3CA, PIK3CB TDP1 619/4885L3MBTL1 3859/4885TSHR 2357/4885

“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.