SCHEMBL14815833

SCHEMBL14815833

O=S(=O)(c1ccc(C(F)(F)F)nc1)N1CCN2C[C@H](Oc3cnc(C4CC4)cn3)C[C@H]2C1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 2/20 0.38
▸ SCN3A Q9NY46 1/20 0.36
▸ PSEN1 P49768 10/20 0.35
▸ PSEN2 P49810 10/20 0.35
▸ APH1B Q8WW43 10/20 0.35
▸ NCSTN Q92542 10/20 0.35
▸ APH1A Q96BI3 10/20 0.35
▸ PSENEN Q9NZ42 10/20 0.35
▸ GCK P35557 1/20 0.35
▸ NAAA Q02083 1/20 0.34
▸ TRPV4 Q9HBA0 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33

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
SCHEMBL15462465 1.00 GPR119 (0.38) GPR119SCN3APSEN1PSEN2APH1B
SCHEMBL14815434 0.91 KDM4E (0.41) GPR119SCN3ATRPV4LMNA
SCHEMBL14816147 0.91 KDM4E (0.41) GPR119SCN3ATRPV4LMNA
SCHEMBL14815581 0.91 KDM4E (0.41) GPR119SCN3ATRPV4LMNA
SCHEMBL14815749 0.89 POLB (0.43) GPR119LMNA
SCHEMBL15462522 0.89 POLB (0.43) GPR119LMNA
SCHEMBL14815885 0.88 KCNH2 (0.40) GPR119GCKLMNA
SCHEMBL14815402 0.88 MAPT (0.39) LMNA
SCHEMBL15462473 0.88 MAPT (0.39) LMNA
SCHEMBL14815583 0.88 SCN3A (0.38) GPR119SCN3ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130085141-A1 SUBSTITUTED OCTAHYDROPYRROLO[1,2-a]PYRAZINE SULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBVIE INC. (US) 2013-04-04 — — US claimed
US-8648074-B2 Substituted octahydropyrrolo[1,2-a]pyrazine sulfonamides as calcium channel blockers ABBVIE INC. (US) 2014-02-11 — — US disclosed
US-20130085141-A1 SUBSTITUTED OCTAHYDROPYRROLO[1,2-a]PYRAZINE SULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBVIE INC. (US) 2013-04-04 — — US 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-20130085141-A1 SUBSTITUTED OCTAHYDROPYRROLO[1,2-a]PYRAZINE SULFONAMIDES AS CALCIUM CHANNEL BLOCKERS CACNA1C, CACNA1D, CACNA1A GPR119 2105/4885SCN3A 116/4885PSEN1 629/4885

“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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