SCHEMBL14816193

SCHEMBL14816193

O=S(=O)(c1ccc(Cl)cc1)N1CCN2C[C@H](Oc3cnc(C4CC4)cn3)C[C@H]2C1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ CNR1 P21554 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ POLB P06746 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ LMNA P02545 2/20 0.37
▸ PKM P14618 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ FPR2 P25090 1/20 0.35
▸ PROKR1 Q8TCW9 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
SCHEMBL15462523 1.00 ALDH1A1 (0.44) ALDH1A1MEN1KMT2AMAPK1CNR1
SCHEMBL14815749 0.91 POLB (0.43) ALDH1A1MEN1KMT2AMAPK1POLB
SCHEMBL15462522 0.91 POLB (0.43) ALDH1A1MEN1KMT2AMAPK1POLB
SCHEMBL15462489 0.91 MEN1 (0.43) MEN1KMT2ALMNA
SCHEMBL14815396 0.91 MEN1 (0.43) MEN1KMT2ALMNA
SCHEMBL14815794 0.90 CNR1 (0.39) ALDH1A1MEN1KMT2AMAPK1CNR1
SCHEMBL14815545 0.90 SMN1; SMN2 (0.44) ALDH1A1MEN1KMT2APOLBKDM4E
SCHEMBL15462473 0.90 MAPT (0.39) ALDH1A1KMT2ATP53KDM4ELMNA
SCHEMBL15462509 0.90 CNR1 (0.39) ALDH1A1MEN1KMT2AMAPK1CNR1
SCHEMBL14815402 0.90 MAPT (0.39) ALDH1A1KMT2ATP53KDM4ELMNA

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 ALDH1A1 1439/4885MEN1 1999/4885KMT2A 1876/4885

“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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