SCHEMBL1379328

SCHEMBL1379328

Cc1ccc(S(=O)(=O)Nc2cc3cccnc3c(N3CCNCC3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 6/20 0.50
▸ CKS1B P61024 5/20 0.50
▸ SKP2 Q13309 5/20 0.50
▸ LMNA P02545 4/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ MAPT P10636 3/20 0.50
▸ SLC40A1 Q9NP59 3/20 0.50
▸ HTT P42858 3/20 0.50
▸ AGTR1 P30556 2/20 0.50
▸ NPSR1 Q6W5P4 2/20 0.50
▸ MITF O75030 1/20 0.50
▸ S1PR4 O95977 1/20 0.50
▸ S1PR1 P21453 1/20 0.50
▸ OPRK1 P41145 1/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ TP53 P04637 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ TSHR P16473 1/20 0.49

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 0.91 SLC40A1 (0.49) TDP1SLC40A1AGTR1PRKD1HTR6
SCHEMBL3616470 0.90 MEN1 (0.50) TDP1KMT2AALDH1A1SLC40A1HTT
SCHEMBL3627476 0.85 MEN1 (0.53) KMT2AALDH1A1MEN1KDM4EGAA
SCHEMBL7045566 0.85 PRKD1 (0.49) LMNAHTTPRKD1HTR6
Trifluoroacetic Acid SCHEMBL1380515 0.82 RAD52 (0.43) TDP1KMT2ASLC40A1MEN1PRKD1
SCHEMBL3623702 0.82 SLC40A1 (0.58) CKS1BSKP2ALDH1A1SLC40A1TSHR
SCHEMBL1380555 0.81 NFKBIA (0.51) TDP1LMNAKMT2AALDH1A1MAPT
SCHEMBL3616367 0.81 HTR6 (0.51) KMT2AMAPTMEN1TSHRPRKD1
SCHEMBL1377405 0.79 SLC40A1 (0.54) KMT2ASLC40A1MEN1PRKD1NMT1
Trifluoroacetic Acid SCHEMBL1379813 0.79 HTR6 (0.47) KMT2AALDH1A1MEN1KDM4EGAA

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 TDP1 4016/4885CKS1B 3264/4885SKP2 1743/4885
US-20070066598-A1 Compounds SULT2A1, STS, SLC5A2 TDP1 4117/4885CKS1B 3650/4885SKP2 1451/4885
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 TDP1 2654/4885CKS1B 3626/4885SKP2 925/4885
US-20070066600-A1 Compounds SULT2A1, STS, SLC5A2 TDP1 4117/4885CKS1B 3650/4885SKP2 1451/4885
US-20100222330-A1 New Compounds SULT2A1, GPR119, STS TDP1 4016/4885CKS1B 3264/4885SKP2 1743/4885

“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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