SCHEMBL14815191

SCHEMBL14815191

CC(C)(C)OC(=O)N1CCN2CC[C@@H](Oc3ccc(Cl)cn3)[C@H]2C1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 2/20 0.43
▸ FNTA P49354 4/20 0.43
▸ FNTB P49356 4/20 0.43
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TACR3 P29371 2/20 0.40
▸ USP2 O75604 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ USP30 Q70CQ3 3/20 0.39
▸ PIK3CD O00329 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ FAAH O00519 1/20 0.39
▸ STS P08842 2/20 0.39
▸ HCRTR1 O43613 1/20 0.39
▸ CNR1 P21554 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
SCHEMBL14815189 1.00 GPR119 (0.43) GPR119FNTAFNTBMEN1KMT2A
SCHEMBL14833265 0.85 HCRTR1 (0.41) TACR3HCRTR1
SCHEMBL5672367 0.81 GPR119 (0.58) GPR119PIK3CD
SCHEMBL5672385 0.81 GPR119 (0.58) GPR119PIK3CD
SCHEMBL5270529 0.79 GPR119 (0.51) GPR119MEN1KMT2APIK3CD
SCHEMBL2775134 0.79 GPR119 (0.66) GPR119MEN1KMT2AUSP2HPGD
SCHEMBL14815083 0.76 MGLL (0.48) KMT2AHPGDPOLBFAAHHCRTR1
SCHEMBL14815085 0.76 MGLL (0.48) KMT2AHPGDPOLBFAAHHCRTR1
SCHEMBL14815181 0.76 MGLL (0.48) KMT2AHPGDPOLBFAAHHCRTR1
SCHEMBL17510649 0.75 HCRTR1 (0.59) HCRTR1

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-8669255-B2 Substituted octahydropyrrolo[1,2-a]pyrazines as calcium channel blockers ABBVIE INC. (US) 2014-03-11 — — US disclosed
US-8648074-B2 Substituted octahydropyrrolo[1,2-a]pyrazine sulfonamides as calcium channel blockers ABBVIE INC. (US) 2014-02-11 — — US disclosed
US-20130085142-A1 SUBSTITUTED OCTAHYDROPYRROLO[1,2-a]PYRAZINES AS CALCIUM CHANNEL BLOCKERS ABBVIE INC. (US) 2013-04-04 — — US disclosed
WO-2013049174-A1 SUBSTITUTED OCTAHYDROPYRROLO[1,2-A]PYRAZINE SULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBVIE INC. (US) 2013-04-04 — — WO 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 (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-20130085142-A1 SUBSTITUTED OCTAHYDROPYRROLO[1,2-a]PYRAZINES AS CALCIUM CHANNEL BLOCKERS CACNA1C, CACNA1E, CACNA1D GPR119 1400/4885FNTA 4657/4885FNTB 3595/4885
US-20130085141-A1 SUBSTITUTED OCTAHYDROPYRROLO[1,2-a]PYRAZINE SULFONAMIDES AS CALCIUM CHANNEL BLOCKERS CACNA1C, CACNA1D, CACNA1A GPR119 2105/4885FNTA 4796/4885FNTB 3747/4885

“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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