SCHEMBL2240982

SCHEMBL2240982

COc1ccc(NS(=O)(=O)c2ccc(N)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.73
▸ GAA P10253 2/20 0.73
▸ MAPK1 P28482 2/20 0.73
▸ HTR6 P50406 1/20 0.70
▸ ALDH1A1 P00352 4/20 0.68
▸ PGR P06401 1/20 0.68
▸ HTT P42858 2/20 0.65
▸ CA1 P00915 1/20 0.65
▸ CA2 P00918 1/20 0.65
▸ CA9 Q16790 1/20 0.65
▸ CYP19A1 P11511 1/20 0.64
▸ PKM P14618 2/20 0.63
▸ MAPT P10636 3/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ MEN1 O00255 2/20 0.62
▸ SMN1; SMN2 Q16637 2/20 0.62
▸ KDM4E B2RXH2 1/20 0.62
▸ BLM P54132 1/20 0.62
▸ TDP1 Q9NUW8 1/20 0.62
▸ GFER P55789 1/20 0.62

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
SCHEMBL29118855 1.00 LMNA (0.73) LMNAGAAMAPK1HTR6ALDH1A1
SCHEMBL12167748 0.95 PGR (0.76) LMNAGAAMAPK1HTR6ALDH1A1
SCHEMBL790294 0.91 GAA (0.86) LMNAGAAMAPK1ALDH1A1PGR
SCHEMBL18386666 0.86 CA1 (0.69) HTR6ALDH1A1PGRHTTCA1
SCHEMBL32679643 0.86 GAA (0.78) LMNAGAAMAPK1ALDH1A1PGR
SCHEMBL540915 0.86 CA1 (0.85) HTR6ALDH1A1HTTCA1CA2
SCHEMBL11793140 0.86 CA1 (0.85) HTR6ALDH1A1HTTCA1CA2
SCHEMBL7823465 0.85 HTR6 (0.88) LMNAHTR6HTTCA1CA2
SCHEMBL806437 0.85 GAA (0.76) LMNAGAAMAPK1ALDH1A1PGR
SCHEMBL29031235 0.85 PGR (0.85) LMNAGAAMAPK1ALDH1A1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118084744-A Aloe-emodin derivative and preparation method and application thereof 广西民族大学 2024-05-28 — — CN disclosed
CN-115955968-A Carbohydrazone acyldinitrile compounds comprising at least two aryl or heteroaryl groups connected by a novel linker and uses thereof 韩国科学技术研究院 2023-04-11 — — CN disclosed
WO-2020183011-A1 HTR1D INHIBITORS AND USES THEREOF IN THE TREATMENT OF CANCER INSTITUT CURIE (FR) 2020-09-17 — — WO disclosed
US-8673910-B2 Proteasome inhibitors for selectively inducing apoptosis in cancer cells H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE (US) 2014-03-18 — — US disclosed
US-8673910-B2 Proteasome inhibitors for selectively inducing apoptosis in cancer cells H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE (US) 2014-03-18 — — US disclosed
US-20110201609-A1 PROTEASOME INHIBITORS FOR SELECTIVELY INDUCING APOPTOSIS IN CANCER CELLS H. LEE MOFFITT CANCER CENTER & RESEARCH INSTITUTE (US) 2011-08-18 — — US disclosed
US-20110201609-A1 PROTEASOME INHIBITORS FOR SELECTIVELY INDUCING APOPTOSIS IN CANCER CELLS H. LEE MOFFITT CANCER CENTER & RESEARCH INSTITUTE (US) 2011-08-18 — — US disclosed
WO-2011022393-A2 PHOSPHATIDYLCHOLINE TRANSFER PROTEIN INHIBITORS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2011-02-24 — — WO disclosed
WO-2010005534-A2 PROTEASOME INHIBITORS FOR SELECTIVELY INDUCING APOPTOSIS IN CANCER CELLS H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2010-01-14 — — WO disclosed
US-20090233878-A1 NOVEL ADENOSINE A3 RECEPTOR AGONISTS CREDIT SUISSE AG 2009-09-17 — — US disclosed
US-7511133-B2 Adenosine A3 receptor agonists KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. (US) 2009-03-31 — — US disclosed
CN-101074242-A Cells accumulation for sphosphonate analogs of HIV protease inhibitor compound and the same compound GILEAD SCIENCES INC (US) 2007-11-21 — — CN disclosed
CN-1313472-C Cellular Accumulation of Phosphonate Analogs of HIV Protease Inhibitor Compounds and Such Compounds GILEAD SCIENCES INC (US) 2007-05-02 — — CN disclosed
US-20070010526-A1 Therapeutic isoquinoline compounds ASTRAZENECA AB (SE) 2007-01-11 — — US disclosed
US-20050250729-A1 Novel adenosine A3 receptor agonists KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. 2005-11-10 — — US disclosed
CN-1649885-A Cellular Accumulation of Phosphonate Analogs of HIV Protease Inhibitor Compounds and Such Compounds GILEAD SCIENCES INC (US) 2005-08-03 — — CN disclosed
EP-1451172-A1 THERAPEUTIC ISOQUINOLINE COMPOUNDS AstraZeneca AB (SE) 2004-09-01 — — EP disclosed
CN-1110489-C Benzisoelenazolone sulfamide derivative, its preparing process and its application in preparing medicines INST OF PHARMACOLOGY CHINESE A (CN) 2003-06-04 — — CN disclosed
WO-2003037887-A1 THERAPEUTIC ISOQUINOLINE COMPOUNDS ASTRAZENECA AB (SE) 2003-05-08 — — WO disclosed
CN-1253135-A Benzisoelenazolone sulfamide derivative, its preparing process and its application in preparing medicines INST OF PHARMACOLOGY CHINESE A (CN) 2000-05-17 — — CN 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-20090233878-A1 NOVEL ADENOSINE A3 RECEPTOR AGONISTS ADORA3, ADORA1, ADORA2A LMNA 3472/4885GAA 3857/4885MAPK1 2121/4885
US-20070010526-A1 Therapeutic isoquinoline compounds HTR1B, HTR1D, HTR1A LMNA 1833/4885GAA 639/4885MAPK1 3018/4885
US-20050250729-A1 Novel adenosine A3 receptor agonists ADORA3, ADORA2A, ADORA1 LMNA 4090/4885GAA 4207/4885MAPK1 2357/4885
US-20110201609-A1 PROTEASOME INHIBITORS FOR SELECTIVELY INDUCING APOPTOSIS IN CANCER CELLS PSMB7, PSMD7, PSMB6 LMNA 2096/4885GAA 2338/4885MAPK1 3066/4885

“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.

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