SCHEMBL1778714

SCHEMBL1778714

CCc1cccc(CC)c1NS(=O)(=O)c1cc2c(N3CCN(C(=O)OC(C)(C)C)CC3)nccc2s1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.45
KIT P10721 2/20 0.43
MMP13 P45452 6/20 0.42
TGFBR1 P36897 4/20 0.41
CXCR2 P25025 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TLR9 Q9NR96 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
GBA1 P04062 1/20 0.38
MMP1 P03956 1/20 0.37
CKS1B P61024 1/20 0.37
SKP1 P63208 1/20 0.37
SKP2 Q13309 1/20 0.37
DTYMK P23919 1/20 0.37

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
SCHEMBL5063132 0.83 KIT (0.42) ACHEKITMMP13CXCR2TLR9
SCHEMBL1775437 0.82 ACHE (0.47) ACHEKITMMP13MEN1KMT2A
SCHEMBL1776023 0.81 HTR2C (0.43)
SCHEMBL1775796 0.81 SLC2A1 (0.48) ACHEKITMMP13MEN1KMT2A
SCHEMBL1774569 0.81 KIT (0.45) ACHEKITMMP13TGFBR1MEN1
Hydrochloric Acid SCHEMBL1776078 0.81 HTR2C (0.42)
SCHEMBL1775510 0.80 ACHE (0.48) ACHEKITMMP13TLR9TLR7
SCHEMBL1774019 0.80 TGFBR1 (0.40) ACHEKITMMP13TGFBR1MEN1
SCHEMBL1774424 0.80 GBA1 (0.42) ACHEKITMMP13TGFBR1MEN1
SCHEMBL1775413 0.80 MALT1 (0.48) KITTGFBR1TLR9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7943639-B2 Such as 6-benzenesulfonyl-4-piperazin-1-yl-quinoline hydrochloride; for treatment of central nervous system and/or 5- HT6 receptor related disorders; for weight gain/loss PROXIMAGEN LIMITED (GB) 2011-05-17 US disclosed
EP-1897881-A2 Compounds useful for the treatment of obesity, type II diabetes and CNS disorders Biovitrum AB (publ) (SE) 2008-03-12 EP disclosed
EP-1513828-A1 NEW COMPOUNDS USEFUL FOR THE TREATMENT OF OBESITY, TYPE II DIABETES AND CNS DISORDERS Biovitrum AB (SE) 2005-03-16 EP disclosed
US-20040024210-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2004-02-05 US disclosed
WO-2004000828-A1 NEW COMPOUNDS USEFUL FOR THE TREATMENT OF OBESITY, TYPE II DIABETES AND CNS DISORDERS BIOVITRUM AB (SE) 2003-12-31 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 (1 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-20040024210-A1 New compounds SULT1E1, SULT2A1, SULT1A1 ACHE 3068/4885KIT 4787/4885MMP13 2592/4885

“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.