SCHEMBL3581469

SCHEMBL3581469

CS(=O)(=O)c1ccc(I)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.39
PIP5K1C O60331 1/20 0.39
PIK3CB P42338 1/20 0.39
PI4KA P42356 1/20 0.39
PIK3CG P48736 1/20 0.39
PI4KB Q9UBF8 1/20 0.39
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA13 Q8N1Q1 1/20 0.36
CA14 Q9ULX7 1/20 0.36
EDNRA P25101 1/20 0.33
RORC P51449 1/20 0.33
CHRNA7 P36544 1/20 0.33
LRRK2 Q5S007 1/20 0.32

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
SCHEMBL2345590 0.79 PSIP1 (0.34) CA12CA1CA2CA4CA6
SCHEMBL3640748 0.78 TET2 (0.40) CA12CA1CA2CA4CA6
SCHEMBL713957 0.78 CA12 (0.36) CA12CA1CA2CA4CA6
SCHEMBL24899890 0.78 POLB (0.44) CA12CA1CA2CA4CA6
SCHEMBL26107943 0.77 PI4KB (0.55) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG
SCHEMBL2572656 0.76 ENPP2 (0.43) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG
SCHEMBL2645412 0.76 PIK3CD (0.40) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG
SCHEMBL486163 0.76 CCR1 (0.46) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG
SCHEMBL24899889 0.75 CA12 (0.32) CA12CA1CA2CA4CA6
SCHEMBL1492547 0.74 CA12 (0.67) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12564636-B2 Pnictogen-containing heterocyclic compounds and their use UNIVERSITY OF RHODE ISLAND BOARD OF TRUSTEES (US) 2026-03-03 US disclosed
US-20240285772-A1 PNICTOGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE COLGATE UNIVERSITY 2024-08-29 US disclosed
WO-2023191953-A1 PNICTOGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE UNIVERSITY OF RHODE ISLAND BOARD OF TRUSTEES (US) 2023-10-05 WO disclosed
WO-2021041866-A1 SMALL MOLECULE AGONISTS OF MUCOLIPIN 1 AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2021-03-04 WO disclosed
EP-2847196-B1 NEW 2,3-DIHYDRO-FURO[2,3-C]PYRIDINES, THEIR USE AS MODULATORS OF THE G-PROTEIN-COUPLED RECEPTOR GPR119 AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM BOEHRINGER INGELHEIM INT (DE) 2017-10-25 EP disclosed
CN-1989115-B Oxazole derivatives as histamine H3 receptor drugs and preparation and pharmaceutical use thereof LILLY CO ELI 2012-03-21 CN disclosed
US-7666871-B2 3-Methyl-6-(4-{5-methyl-4-[2-(2-methyl-pyrrolidin-1-yl)-ethyl]-oxazol-2-yl}-phenyl)-pyridazine; for treatment of obesity, cognitive deficiencies, narcolepsy ELI LILLY AND COMPANY (US) 2010-02-23 US disclosed
US-7666871-B2 3-Methyl-6-(4-{5-methyl-4-[2-(2-methyl-pyrrolidin-1-yl)-ethyl]-oxazol-2-yl}-phenyl)-pyridazine; for treatment of obesity, cognitive deficiencies, narcolepsy ELI LILLY AND COMPANY (US) 2010-02-23 US disclosed
US-7666871-B2 3-Methyl-6-(4-{5-methyl-4-[2-(2-methyl-pyrrolidin-1-yl)-ethyl]-oxazol-2-yl}-phenyl)-pyridazine; for treatment of obesity, cognitive deficiencies, narcolepsy ELI LILLY AND COMPANY (US) 2010-02-23 US disclosed
EP-1786790-B1 OXAZOLE DERIVATIVES AS HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES LILLY CO ELI (US) 2009-06-03 EP disclosed
US-20070197604-A1 Oxazole derivatives as histamine h3 receptor agents,preparation and therapeutic uses ELI LILLY AND COMPANY 2007-08-23 US disclosed
US-20070197604-A1 Oxazole derivatives as histamine h3 receptor agents,preparation and therapeutic uses ELI LILLY AND COMPANY 2007-08-23 US disclosed
US-20070197604-A1 Oxazole derivatives as histamine h3 receptor agents,preparation and therapeutic uses ELI LILLY AND COMPANY 2007-08-23 US disclosed
CN-1989115-A * azole derivatives as histamine H3 receptor agents, their preparation and therapeutic use LILLY CO ELI (US) 2007-06-27 CN disclosed
EP-1786790-A1 OXAZOLE DERIVATIVES AS HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-05-23 EP disclosed
WO-2006019833-A1 OXAZOLE DERIVATIVES AS HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2006-02-23 WO 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 (3 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-20070197604-A1 Oxazole derivatives as histamine h3 receptor agents,preparation and therapeutic uses HCRTR1, HRH3, HCRTR2 PIK3CD 2191/4885PIP5K1C 1802/4885PIK3CB 2887/4885
US-12564636-B2 Pnictogen-containing heterocyclic compounds and their use CBR1, PNPO, NOX3 PIK3CD 2691/4885PIP5K1C 2989/4885PIK3CB 2149/4885
US-20240285772-A1 PNICTOGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE PYGL, UGT2B7, CYP2E1 PIK3CD 4091/4885PIP5K1C 3694/4885PIK3CB 2834/4885

“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.