SCHEMBL13731063

SCHEMBL13731063

CCN(CC)CCOc1cc(F)cc(S(C)(=O)=O)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.47
▸ CHRNA7 P36544 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ HRH3 Q9Y5N1 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ EBP Q15125 1/20 0.39
▸ SIGMAR1 Q99720 1/20 0.39
▸ ALK Q9UM73 1/20 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
SCHEMBL13730581 0.83 GBA1 (0.41) MAPT
SCHEMBL13730672 0.82 EPAS1 (0.38) —
SCHEMBL13731094 0.79 LOX (0.39) —
SCHEMBL29655157 0.77 NR1H2 (0.34) —
SCHEMBL13732231 0.77 ALDH1A1 (0.39) —
Mesdopetam SCHEMBL29438808 0.76 KAT6A (0.40) TSHR
Mesdopetam SCHEMBL13732678 0.76 KAT6A (0.40) TSHR
Mesdopetam SCHEMBL29438806 0.76 KAT6A (0.40) TSHR
SCHEMBL25405123 0.75 EPAS1 (0.37) —
SCHEMBL30807872 0.75 GBA1 (0.41) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2699543-B1 NOVEL MODULATORS OF CORTICAL DOPAMINERGIC- AND NMDA-RECEPTOR-MEDIATED GLUTAMATERGIC NEUROTRANSMISSION INTEGRATIVE RES LAB SWEDEN AB (SE) 2016-03-02 — — EP claimed
US-9006227-B2 Modulators of cortical dopaminergic- and NMDA-receptor-mediated glutamatergic neurotransmission INTEGRATIVE RESEARCH LABORATORIES SWEDEN AB (SE) 2015-04-14 — — US claimed
US-20140128360-A1 NOVEL MODULATORS OF CORTICAL DOPAMINERGIC- AND NMDA-RECEPTOR-MEDIATED GLUTAMATERGIC NEUROTRANSMISSION Integrative Research Laboratories Swenden AB (SE) 2014-05-08 — — US claimed
EP-2699543-A1 NOVEL MODULATORS OF CORTICAL DOPAMINERGIC- AND NMDA-RECEPTOR-MEDIATED GLUTAMATERGIC NEUROTRANSMISSION Integrative Research Laboratories Sweden AB (SE) 2014-02-26 — — EP claimed
WO-2012143337-A1 NOVEL MODULATORS OF CORTICAL DOPAMINERGIC- AND NMDA-RECEPTOR-MEDIATED GLUTAMATERGIC NEUROTRANSMISSION NEUROSEARCH A/S (DK) 2012-10-26 — — WO claimed
EP-2699543-B1 NOVEL MODULATORS OF CORTICAL DOPAMINERGIC- AND NMDA-RECEPTOR-MEDIATED GLUTAMATERGIC NEUROTRANSMISSION INTEGRATIVE RES LAB SWEDEN AB (SE) 2016-03-02 — — EP disclosed
US-9120728-B2 Modulators of cortical dopaminergic- and NMDA-receptor-mediated glutamatergic neurotransmission INTEGRATIVE RESEARCH LABORATORIES SWEDEN AB (SE) 2015-09-01 — — US disclosed
US-20150148426-A1 NOVEL MODULATORS OF CORTICAL DOPAMINERGIC- AND NMDA-RECEPTOR-MEDIATED GLUTAMATERGIC NEUROTRANSMISSION INTEGRATIVE RESEARCH LABORATORIES SWEDEN AB (SE) 2015-05-28 — — US disclosed
US-9006227-B2 Modulators of cortical dopaminergic- and NMDA-receptor-mediated glutamatergic neurotransmission INTEGRATIVE RESEARCH LABORATORIES SWEDEN AB (SE) 2015-04-14 — — US disclosed
US-20140128360-A1 NOVEL MODULATORS OF CORTICAL DOPAMINERGIC- AND NMDA-RECEPTOR-MEDIATED GLUTAMATERGIC NEUROTRANSMISSION Integrative Research Laboratories Swenden AB (SE) 2014-05-08 — — US disclosed
EP-2699543-A1 NOVEL MODULATORS OF CORTICAL DOPAMINERGIC- AND NMDA-RECEPTOR-MEDIATED GLUTAMATERGIC NEUROTRANSMISSION Integrative Research Laboratories Sweden AB (SE) 2014-02-26 — — EP disclosed
WO-2012143337-A1 NOVEL MODULATORS OF CORTICAL DOPAMINERGIC- AND NMDA-RECEPTOR-MEDIATED GLUTAMATERGIC NEUROTRANSMISSION NEUROSEARCH A/S (DK) 2012-10-26 — — 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 (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-20140128360-A1 NOVEL MODULATORS OF CORTICAL DOPAMINERGIC- AND NMDA-RECEPTOR-MEDIATED GLUTAMATERGIC NEUROTRANSMISSION GRIN3A, GRIN1, GRIN3B MAPT 608/4885CHRNA7 42/4885KMT2A 639/4885
US-20150148426-A1 NOVEL MODULATORS OF CORTICAL DOPAMINERGIC- AND NMDA-RECEPTOR-MEDIATED GLUTAMATERGIC NEUROTRANSMISSION GRIN3A, GRIN1, GRIN3B MAPT 608/4885CHRNA7 42/4885KMT2A 639/4885

“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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