SCHEMBL1380902

SCHEMBL1380902

O=S(=O)(Cc1ccccc1)Nc1cc2cccnc2c(N2CCNCC2)n1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GLO1 Q04760 3/20 0.51
▸ PRKD1 Q15139 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ HTR2A P28223 2/20 0.42
▸ HTR2C P28335 2/20 0.42
▸ SLC6A4 P31645 1/20 0.42
▸ ACHE P22303 1/20 0.41
▸ HTR6 P50406 5/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ DRD2 P14416 1/20 0.41
▸ HTR7 P34969 1/20 0.41
▸ PDE4A P27815 1/20 0.41
▸ PDE4B Q07343 1/20 0.41
▸ PDE4C Q08493 1/20 0.41
▸ PDE4D Q08499 1/20 0.41
▸ HSD11B1 P28845 1/20 0.39

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
SCHEMBL7045097 0.85 SLC40A1 (0.49) GLO1PRKD1HTR2AHTR2CSLC6A4
SCHEMBL3619544 0.84 PRKD1 (0.44) GLO1PRKD1KDM4EALDH1A1HPGD
SCHEMBL7045566 0.84 PRKD1 (0.49) GLO1PRKD1HTR2AHTR2CSLC6A4
SCHEMBL3616367 0.80 HTR6 (0.51) PRKD1HTR2AHTR2CSLC6A4HTR6
Trifluoroacetic Acid SCHEMBL1380171 0.79 L3MBTL1 (0.43) PRKD1HTR2AHTR2CSLC6A4HTR6
SCHEMBL1379328 0.78 TDP1 (0.50) PRKD1KDM4EALDH1A1HPGDHTR6
SCHEMBL3616470 0.78 MEN1 (0.50) PRKD1ALDH1A1HTR2AHTR2CSLC6A4
SCHEMBL1380555 0.78 NFKBIA (0.51) GLO1PRKD1KDM4EALDH1A1HPGD
SCHEMBL1377405 0.76 SLC40A1 (0.54) PRKD1HTR6HTR1ADRD2HTR7
SCHEMBL3623702 0.75 SLC40A1 (0.58) PRKD1ALDH1A1HTR2CHTR6HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4731114-B2 — — 2011-07-20 — — JP claimed
US-20100222330-A1 New Compounds BIOVITRUM AB (SE) 2010-09-02 — — US claimed
US-20070066598-A1 Compounds BIOVITRUM AB, A SWEDEN CORPORATION 2007-03-22 — — US claimed
EP-1412325-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS, PROCESS FOR THEIR USE AS MEDICAMENT FOR THE TREATMENT OF CNS DISORDERS, OBESITY AND TYPE II DIABETES BIOVITRUM AB (SE) 2004-04-28 — — EP claimed
US-20030158202-A1 Substituted fused ring sulfonamides containing, e.g., naphthalene, isoquinoline, quinoline, benzofuran or benzothiophene rings; treatment of conditions relating to obesity, type II diabetes and CNS disorders PROXIMAGEN NEUROSCIENCE PLC (GB) 2003-08-21 — — US claimed
WO-2002100822-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS, PROCESS FOR THEIR USE AS MEDICAMENT FOR THE TREATMENT OF CNS DISORDERS, OBESITY AND TYPE II DIABETES BIOVITRUM AB (SE) 2002-12-19 — — WO claimed
US-20100222330-A1 New Compounds BIOVITRUM AB (SE) 2010-09-02 — — US disclosed
US-7572787-B2 Substituted naphthalene sulfonamides BIOVITRUM AB (SE) 2009-08-11 — — US disclosed
US-20070066598-A1 Compounds BIOVITRUM AB, A SWEDEN CORPORATION 2007-03-22 — — US disclosed
US-20070066599-A1 New compounds BIOVITRUM AB, A SWEDEN CORPORATION 2007-03-22 — — US disclosed
US-20070066600-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2007-03-22 — — US disclosed
US-7144883-B2 Bicyclic sulfonamide compounds BIOVITRUM AB (SE) 2006-12-05 — — US disclosed
US-20030158202-A1 Substituted fused ring sulfonamides containing, e.g., naphthalene, isoquinoline, quinoline, benzofuran or benzothiophene rings; treatment of conditions relating to obesity, type II diabetes and CNS disorders PROXIMAGEN NEUROSCIENCE PLC (GB) 2003-08-21 — — 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 (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-20070066599-A1 New compounds SULT2A1, GPR119, STS GLO1 639/4885PRKD1 4439/4885KDM4E 3591/4885
US-20070066598-A1 Compounds SULT2A1, STS, SLC5A2 GLO1 752/4885PRKD1 4705/4885KDM4E 3286/4885
US-20030158202-A1 Substituted fused ring sulfonamides containing, e.g., naphthalene, isoquinoline, quinoline, benzofuran or benzothiophene rings; treatment of conditions relating to obesity, type II diabetes and CNS disorders SULT2A1, SULT1A1, SULT1E1 GLO1 1409/4885PRKD1 4604/4885KDM4E 3527/4885
US-20070066600-A1 Compounds SULT2A1, STS, SLC5A2 GLO1 752/4885PRKD1 4705/4885KDM4E 3286/4885
US-20100222330-A1 New Compounds SULT2A1, GPR119, STS GLO1 639/4885PRKD1 4439/4885KDM4E 3591/4885

“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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