SCHEMBL1775413

SCHEMBL1775413

COc1cc(NS(=O)(=O)c2cc3c(N4CCN(C(=O)OC(C)(C)C)CC4)nccc3s2)c(OC)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 3/20 0.48
ALK Q9UM73 3/20 0.42
SUV39H2 Q9H5I1 7/20 0.41
TGFBR1 P36897 1/20 0.40
PGK1 P00558 1/20 0.40
TLR9 Q9NR96 1/20 0.40
KIT P10721 1/20 0.39
BRD4 O60885 1/20 0.39
EGFR P00533 2/20 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
SCHEMBL1777009 0.86 MALT1 (0.48) MALT1BRD4
Hydrochloric Acid SCHEMBL1775834 0.85 MALT1 (0.47) MALT1BRD4
SCHEMBL1775048 0.84 HTR6 (0.49) MALT1
Hydrochloric Acid SCHEMBL1773877 0.83 HTR6 (0.48) MALT1
SCHEMBL1775414 0.81 TLR9 (0.41) MALT1ALKSUV39H2PGK1TLR9
SCHEMBL1778714 0.80 ACHE (0.45) TGFBR1TLR9KIT
SCHEMBL1774019 0.77 TGFBR1 (0.40) TGFBR1KIT
SCHEMBL1775437 0.76 ACHE (0.47) ALKTLR9KIT
SCHEMBL1777001 0.75 KIT (0.42) TLR9KIT
SCHEMBL1775697 0.75 MEN1 (0.48) TGFBR1TLR9KIT

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 MALT1 2170/4885ALK 4581/4885SUV39H2 3768/4885

“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.