SCHEMBL17504102

SCHEMBL17504102

CCCCCC(CCCCC)[S+]([O-])Cc1nccs1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 1/20 0.33
▸ FDPS P14324 1/20 0.33
▸ SLC6A3 Q01959 2/20 0.31
▸ HRH2 P25021 1/20 0.31
▸ HRH1 P35367 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ TLR7 Q9NYK1 1/20 0.31
▸ PLA2G4A P47712 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3511224 0.71 CYP2C19 (0.35) CTSKFDPSSLC6A3SMN1; SMN2
SCHEMBL20995405 0.71 FDPS (0.41) CTSKFDPSSLC6A3HRH2HRH1
SCHEMBL12854076 0.71 FDPS (0.36) FDPSSLC6A3
SCHEMBL21186361 0.70 FDPS (0.41) CTSKFDPSSLC6A3HRH2HRH1
SCHEMBL17504097 0.70 CTSK (0.34) CTSKFDPSSLC6A3HRH2HRH1
SCHEMBL3309122 0.69 PLA2G4A (0.43) FDPSHRH2HRH1L3MBTL1TLR7
SCHEMBL4584005 0.69 PLA2G4A (0.43) FDPSHRH2HRH1L3MBTL1TLR7
SCHEMBL4584723 0.69 PLA2G4A (0.43) FDPSHRH2HRH1L3MBTL1TLR7
SCHEMBL10577019 0.69 PLA2G4A (0.43) FDPSHRH2HRH1L3MBTL1TLR7
SCHEMBL4584899 0.69 PLA2G4A (0.43) FDPSHRH2HRH1L3MBTL1TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2985279-B1 Heterocyclic compounds with working memory enhancing activity RED BULL GMBH (AT) 2017-08-02 — — EP claimed
US-20170174642-A1 HETEROCYCLIC COMPOUNDS WITH WORKING MEMORY ENHANCING ACTIVITY COGMOTIV FLEXCO (AT) 2017-06-22 — — US claimed
WO-2016023997-A1 HETEROCYCLIC COMPOUNDS WITH WORKING MEMORY ENHANCING ACTIVITY RED BULL GMBH (AT) 2016-02-18 — — WO claimed
EP-2985279-A1 Heterocyclic compounds with working memory enhancing activity Red Bull GmbH (AT) 2016-02-17 — — EP claimed
US-10221147-B2 Heterocyclic compounds with working memory enhancing activity RED BULL GMBH (AT) 2019-03-05 — — US disclosed
EP-2985279-B1 Heterocyclic compounds with working memory enhancing activity RED BULL GMBH (AT) 2017-08-02 — — EP disclosed
US-20170174642-A1 HETEROCYCLIC COMPOUNDS WITH WORKING MEMORY ENHANCING ACTIVITY COGMOTIV FLEXCO (AT) 2017-06-22 — — US disclosed
WO-2016023997-A1 HETEROCYCLIC COMPOUNDS WITH WORKING MEMORY ENHANCING ACTIVITY RED BULL GMBH (AT) 2016-02-18 — — WO disclosed
EP-2985279-A1 Heterocyclic compounds with working memory enhancing activity Red Bull GmbH (AT) 2016-02-17 — — EP 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 (2 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-20170174642-A1 HETEROCYCLIC COMPOUNDS WITH WORKING MEMORY ENHANCING ACTIVITY TAAR1, ACHE, RIF1 CTSK 3343/4885FDPS 2877/4885SLC6A3 683/4885
US-10221147-B2 Heterocyclic compounds with working memory enhancing activity TAAR1, ACHE, RIF1 CTSK 3343/4885FDPS 2877/4885SLC6A3 683/4885

“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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