SCHEMBL7952745

SCHEMBL7952745

O=S1(=O)N=C(NC2CCCC2)Nc2cc(Cl)cc(Cl)c21

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 1/20 0.33
RIPK1 Q13546 1/20 0.32
ABCC8 Q09428 1/20 0.32
KCNJ11 Q14654 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
HPGD P15428 1/20 0.31
MAPT P10636 1/20 0.31
KMT5B Q4FZB7 2/20 0.31
KMT5C Q86Y97 2/20 0.31
RAB9A P51151 1/20 0.31
CXCR1 P25024 1/20 0.31
CXCR2 P25025 1/20 0.31

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
SCHEMBL7957445 0.97 HTR5A (0.35) HTR5AABCC8KCNJ11HPGDCXCR1
SCHEMBL7944141 0.95 IL1B (0.33) ABCC8KCNJ11CXCR1CXCR2
SCHEMBL24050255 0.81 ABCC8 (0.45) HTR5ARIPK1ABCC8KCNJ11MAPT
SCHEMBL7944129 0.79 CRHR1 (0.32) CXCR1CXCR2
SCHEMBL6553120 0.78 ABCC8 (0.48) HTR5ARIPK1ABCC8KCNJ11MAPT
SCHEMBL7954367 0.77 CXCR2 (0.32) ABCC8KCNJ11CXCR1CXCR2
SCHEMBL24050507 0.77 ABCC8 (0.53) RIPK1ABCC8KCNJ11MAPTKMT5B
SCHEMBL6553558 0.76 ABCC8 (0.37) HTR5ARIPK1ABCC8KCNJ11MEN1
SCHEMBL717798 0.76 ABCC8 (0.52) RIPK1ABCC8KCNJ11MAPTKMT5B
SCHEMBL7077623 0.75 ABCC8 (0.43) HTR5ARIPK1ABCC8KCNJ11MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11505572-B2 Therapeutics for the treatment of glaucoma MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2022-11-22 US disclosed
US-10981951-B2 Therapeutics for the treatment of glaucoma MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2021-04-20 US disclosed
US-20210040148-A1 THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2021-02-11 US disclosed
US-20170002040-A1 NOVEL THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2017-01-05 US disclosed
EP-3099304-A1 NOVEL THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA Mayo Foundation for Medical Education and Research (US) 2016-12-07 EP disclosed
WO-2015117024-A1 NOVEL THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2015-08-06 WO disclosed
US-6242443-B1 1,2,4-benzothiadiazine derivatives, their preparation and use NOVO NORDISK AIS (DK) 2001-06-05 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 (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-20210040148-A1 THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA KCNJ1, KCNJ2, KCNJ11 HTR5A 1856/4885RIPK1 2101/4885ABCC8 62/4885
US-20170002040-A1 NOVEL THERAPEUTICS FOR THE TREATMENT OF GLAUCOMA KCNJ1, KCNK4, KCNK2 HTR5A 1902/4885RIPK1 2261/4885ABCC8 67/4885
US-11505572-B2 Therapeutics for the treatment of glaucoma KCNJ1, KCNJ2, KCNJ11 HTR5A 1856/4885RIPK1 2101/4885ABCC8 62/4885
US-10981951-B2 Therapeutics for the treatment of glaucoma KCNJ1, KCNJ2, KCNJ11 HTR5A 1856/4885RIPK1 2101/4885ABCC8 62/4885

“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.