SCHEMBL13510093

SCHEMBL13510093

CC(=O)NCc1ccc(S(=O)(=O)Nc2cc(Sc3cccc4cccnc34)c(O)c3ccccc23)s1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.63
▸ KMT2A Q03164 5/20 0.63
▸ KDM4E B2RXH2 2/20 0.63
▸ ALDH1A1 P00352 2/20 0.63
▸ HTR1A P08908 2/20 0.63
▸ MAPT P10636 2/20 0.63
▸ PKM P14618 2/20 0.63
▸ HPGD P15428 2/20 0.63
▸ HTR2A P28223 2/20 0.63
▸ HTR7 P34969 2/20 0.63
▸ HTT P42858 2/20 0.63
▸ HTR6 P50406 2/20 0.63
▸ SMN1; SMN2 Q16637 2/20 0.63
▸ L3MBTL1 Q9Y468 2/20 0.63
▸ LMNA P02545 1/20 0.63
▸ THRB P10828 2/20 0.60
▸ XBP1 P17861 1/20 0.60
▸ PTBP1 P26599 1/20 0.60
▸ RAB9A P51151 1/20 0.60
▸ KEAP1 Q14145 3/20 0.51

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
SCHEMBL13510030 0.89 MEN1 (0.68) MEN1KMT2AKDM4EALDH1A1HTR1A
SCHEMBL13510031 0.85 MEN1 (0.72) MEN1KMT2AKDM4EALDH1A1HTR1A
SCHEMBL13510010 0.83 MEN1 (0.72) MEN1KMT2AKDM4EALDH1A1HTR1A
SCHEMBL13509762 0.83 BRAF (0.60) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL13510247 0.81 BRAF (0.44) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL13510344 0.81 MCL1 (0.47) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL13509974 0.80 HTT (0.74) MEN1KMT2AKDM4EALDH1A1HTR1A
SCHEMBL13509979 0.79 KDM4E (0.76) MEN1KMT2AKDM4EALDH1A1HTR1A
SCHEMBL13578769 0.79 L3MBTL1 (0.55) MEN1KMT2AKDM4EALDH1A1HTR1A
SCHEMBL13509999 0.78 KDM4E (0.78) MEN1KMT2AKDM4EALDH1A1HTR1A

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11161831-B2 Methods and compositions for treatment of muscle wasting, muscle weakness, and/or cachexia BAYLOR COLLEGE OF MEDICINE (US) 2021-11-02 — — US disclosed
WO-2021113551-A1 THERAPEUTIC COMPOUNDS FOR METHODS OF USE IN INSULIN RESISTANCE BAYLOR COLLEGE OF MEDICINE (US) 2021-06-10 — — WO disclosed
US-20200331880-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF MUSCLE WASTING, MUSCLE WEAKNESS, AND/OR CACHEXIA BAYLOR COLLEGE OF MEDICINE 2020-10-22 — — US disclosed
US-10676455-B2 Methods and compositions for treatment of muscle wasting, muscle weakness, and/or cachexia BAYLOR COLLEGE OF MEDICINE (US) 2020-06-09 — — US disclosed
US-20150051233-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF FIBROSIS BAYLOR COLLEGE OF MEDICINE 2015-02-19 — — US disclosed
US-20150051233-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF FIBROSIS BAYLOR COLLEGE OF MEDICINE 2015-02-19 — — US disclosed
US-20150031714-A1 METHODS AND COMPOSITIONS FOR PREVENTION OF ALLERGIC REACTION BAYLOR COLLEGE OF MEDICINE 2015-01-29 — — US disclosed
US-20150031714-A1 METHODS AND COMPOSITIONS FOR PREVENTION OF ALLERGIC REACTION BAYLOR COLLEGE OF MEDICINE 2015-01-29 — — US disclosed
US-20150024032-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF MUSCLE WASTING, MUSCLE WEAKNESS, AND/OR CACHEXIA BAYLOR COLLEGE OF MEDICINE 2015-01-22 — — US disclosed
US-20150024032-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF MUSCLE WASTING, MUSCLE WEAKNESS, AND/OR CACHEXIA BAYLOR COLLEGE OF MEDICINE 2015-01-22 — — US disclosed
US-20140296270-A1 STAT3 Inhibitors BAYLOR COLLEGE OF MEDICINE (US) 2014-10-02 — — US disclosed
US-20140296270-A1 STAT3 Inhibitors BAYLOR COLLEGE OF MEDICINE (US) 2014-10-02 — — US disclosed
US-8779001-B2 Stat3 inhibitors The United States of America National Institute of Health (NIH) (US) 2014-07-15 — — US disclosed
US-8779001-B2 Stat3 inhibitors The United States of America National Institute of Health (NIH) (US) 2014-07-15 — — US disclosed
US-20110312984-A1 STAT3 INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-12-22 — — US disclosed
US-20100041685-A1 STAT3 INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-02-18 — — US disclosed
US-20100041685-A1 STAT3 INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-02-18 — — 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 (9 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-20150051233-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF FIBROSIS STAT3, MMP1, MMP8 MEN1 4463/4885KMT2A 2075/4885KDM4E 1393/4885
US-10676455-B2 Methods and compositions for treatment of muscle wasting, muscle weakness, and/or cachexia PYGM, MYLK2, STAT3 MEN1 4666/4885KMT2A 1055/4885KDM4E 801/4885
US-11161831-B2 Methods and compositions for treatment of muscle wasting, muscle weakness, and/or cachexia PYGM, MYLK2, STAT3 MEN1 4666/4885KMT2A 1055/4885KDM4E 801/4885
US-20150024032-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF MUSCLE WASTING, MUSCLE WEAKNESS, AND/OR CACHEXIA PYGM, MYLK2, STAT3 MEN1 4666/4885KMT2A 1055/4885KDM4E 801/4885
US-20100041685-A1 STAT3 INHIBITORS STAT3, STAT1, JAK2 MEN1 3720/4885KMT2A 1456/4885KDM4E 2038/4885
US-20200331880-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF MUSCLE WASTING, MUSCLE WEAKNESS, AND/OR CACHEXIA PYGM, MYLK2, STAT3 MEN1 4666/4885KMT2A 1055/4885KDM4E 801/4885
US-20140296270-A1 STAT3 Inhibitors STAT3, STAT1, JAK2 MEN1 3720/4885KMT2A 1456/4885KDM4E 2038/4885
US-20150031714-A1 METHODS AND COMPOSITIONS FOR PREVENTION OF ALLERGIC REACTION JAK2, STAT3, STAT6 MEN1 4165/4885KMT2A 527/4885KDM4E 578/4885
US-20110312984-A1 STAT3 INHIBITORS STAT3, STAT1, JAK2 MEN1 3720/4885KMT2A 1456/4885KDM4E 2038/4885

“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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