SCHEMBL1776197

SCHEMBL1776197

COc1cc(CS(=O)(=O)c2cc3c(N4CCN(C(=O)O)CC4)nccc3s2)cc(OC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.41
AKT2 P31751 1/20 0.41
AKT3 Q9Y243 1/20 0.41
MALT1 Q9UDY8 1/20 0.37
MTNR1B P49286 2/20 0.36
KDM4E B2RXH2 2/20 0.36
KIT P10721 2/20 0.36
MAPK1 P28482 2/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PDGFRB P09619 2/20 0.36
PDGFRA P16234 1/20 0.36
F2 P00734 2/20 0.35
PRSS1 P07477 2/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL1777001 0.90 KIT (0.42) AKT1AKT2AKT3KITMAPT
SCHEMBL1776513 0.87 HTR2C (0.42) FYN
SCHEMBL1776952 0.86 P2RY12 (0.41) AKT1AKT2AKT3KDM4ELMNA
Hydrochloric Acid SCHEMBL1775003 0.86 HTR2C (0.42) FYN
SCHEMBL1775123 0.86 ALDH1A1 (0.42) AKT1AKT2AKT3KDM4EMAPT
SCHEMBL1776231 0.82 AKT1 (0.40) AKT1AKT2AKT3KITKMT2A
SCHEMBL1777439 0.81 P2RY12 (0.35) KDM4EMAPK1MAPTLMNATSHR
SCHEMBL1776477 0.81 AKT1 (0.40) AKT1AKT2AKT3KITLMNA
SCHEMBL1775510 0.79 ACHE (0.48) KIT
SCHEMBL1776820 0.77 MEN1 (0.47) KITLMNAHTTKMT2ASMN1; SMN2

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 AKT1 4344/4885AKT2 3481/4885AKT3 3087/4885

“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.