SCHEMBL1945701

SCHEMBL1945701

O=C(c1ccccn1)N1CCN(S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CC1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.67
▸ MEN1 O00255 2/20 0.67
▸ KMT2A Q03164 2/20 0.67
▸ POLB P06746 1/20 0.67
▸ MAPT P10636 1/20 0.67
▸ GAA P10253 3/20 0.67
▸ SMN1; SMN2 Q16637 1/20 0.67
▸ HSD11B1 P28845 3/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ GRM4 Q14833 1/20 0.52
▸ SFRP1 Q8N474 1/20 0.51
▸ PKM P14618 2/20 0.50
▸ HSD17B10 Q99714 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ SPR P35270 1/20 0.48

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
SCHEMBL17953068 0.84 KMT2A (0.58) LMNAMEN1KMT2APOLBMAPT
SCHEMBL1945685 0.84 GAA (0.77) LMNAKMT2AMAPTGAASMN1; SMN2
SCHEMBL1947656 0.83 GAA (0.66) LMNAGAASMN1; SMN2HSD11B1L3MBTL1
SCHEMBL14777918 0.83 SMN1; SMN2 (0.53) LMNAMEN1KMT2APOLBMAPT
SCHEMBL1946969 0.83 L3MBTL1 (0.68) LMNAMEN1KMT2APOLBMAPT
SCHEMBL1946162 0.82 GAA (0.78) LMNAPOLBMAPTGAASMN1; SMN2
SCHEMBL2225804 0.81 MAPT (0.56) LMNAMEN1KMT2APOLBMAPT
SCHEMBL16087246 0.81 LMNA (0.56) LMNAMEN1KMT2APOLBMAPT
SCHEMBL1429673 0.80 L3MBTL1 (0.70) LMNAMEN1KMT2APOLBMAPT
SCHEMBL17953064 0.80 GAA (1.00) LMNAMEN1KMT2AMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2346828-B1 PIPERAZINE DERIVATIVES USED AS CAV2.2 CALCIUM CHANNEL MODULATORS CONVERGENCE PHARMACEUTICALS (GB) 2012-10-03 — — EP claimed
JP-2011528019-A — — 2011-11-10 — — JP claimed
EP-2346828-A1 PIPERAZINE DERIVATIVES USED AS CAV2.2 CALCIUM CHANNEL MODULATORS Convergence Pharmaceuticals Limited (GB) 2011-07-27 — — EP claimed
US-20110130379-A1 PIPERAZINE DERIVATIVES USED AS CAV2.2 CALCIUM CHANNEL MODULATORS Convergence Pharmaceuticals Limited (GB) 2011-06-02 — — US claimed
WO-2010007072-A1 PIPERAZINE DERIVATIVES USED AS CAV2.2 CALCIUM CHANNEL MODULATORS GLAXO GROUP LIMITED (GB) 2010-01-21 — — WO claimed
US-8530478-B2 Piperazine derivatives used as CAV2.2 calcium channel modulators Convergence Pharmaceuticals Limited (GB) 2013-09-10 — — US disclosed
EP-2346828-B1 PIPERAZINE DERIVATIVES USED AS CAV2.2 CALCIUM CHANNEL MODULATORS CONVERGENCE PHARMACEUTICALS (GB) 2012-10-03 — — EP disclosed
EP-2346828-A1 PIPERAZINE DERIVATIVES USED AS CAV2.2 CALCIUM CHANNEL MODULATORS Convergence Pharmaceuticals Limited (GB) 2011-07-27 — — EP disclosed
US-20110130379-A1 PIPERAZINE DERIVATIVES USED AS CAV2.2 CALCIUM CHANNEL MODULATORS Convergence Pharmaceuticals Limited (GB) 2011-06-02 — — US disclosed
WO-2010007072-A1 PIPERAZINE DERIVATIVES USED AS CAV2.2 CALCIUM CHANNEL MODULATORS GLAXO GROUP LIMITED (GB) 2010-01-21 — — 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 (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-20110130379-A1 PIPERAZINE DERIVATIVES USED AS CAV2.2 CALCIUM CHANNEL MODULATORS CACNA1B, CACNA1C, CACNB2 LMNA 2067/4885MEN1 3979/4885KMT2A 2591/4885

“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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