SCHEMBL1568055

SCHEMBL1568055

Cc1cncn1CCNC(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 1/20 0.52
QPCT Q16769 5/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
HTT P42858 1/20 0.50
KAT2B Q92831 1/20 0.48
MAPT P10636 1/20 0.46
GAA P10253 1/20 0.46
TGM2 P21980 1/20 0.45
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL31252088 0.79 HTT (0.54) SMN1; SMN2LMNAQPCTL3MBTL1HTT
SCHEMBL31252074 0.78 HTT (0.51) SMN1; SMN2LMNAQPCTL3MBTL1HTT
SCHEMBL17410493 0.78 RAB9A (0.52) SMN1; SMN2LMNAQPCTL3MBTL1HTT
SCHEMBL1568420 0.76 L3MBTL1 (0.53) SMN1; SMN2LMNAQPCTL3MBTL1HTT
SCHEMBL12742373 0.75 HSD17B10 (0.67) SMN1; SMN2LMNAHTTMAPTNPC1
SCHEMBL28473741 0.75 SMN1; SMN2 (0.56) SMN1; SMN2LMNAQPCTHTTKAT2B
SCHEMBL13055383 0.75 LMNA (0.80) SMN1; SMN2LMNAL3MBTL1HTTKAT2B
SCHEMBL31311383 0.74 KAT2B (0.58) SMN1; SMN2LMNAL3MBTL1HTTKAT2B
SCHEMBL14416038 0.74 QPCT (0.67) QPCTMAPTGAA
SCHEMBL170570 0.74 LMNA (0.60) SMN1; SMN2LMNAL3MBTL1HTTKAT2B

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-20110105514-A1 5,6,7,8-TETRAHYDRO-IMIDAZO[1,5-A]PYRAZINE COMPOUNDS ACTELION PHARMACEUTICALS LTD. (CH) 2011-05-05 US disclosed
EP-2307417-A2 5,6,7,8-TETRAHYDRO-IMIDAZO[1,5-A]PYRAZINE COMPOUNDS Actelion Pharmaceuticals Ltd. (CH) 2011-04-13 EP disclosed
WO-2009156951-A2 5,6,7,8-TETRAHYDRO-IMIDAZO[1,5-A]PYRAZINE COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2009-12-30 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-20110105514-A1 5,6,7,8-TETRAHYDRO-IMIDAZO[1,5-A]PYRAZINE COMPOUNDS HCRTR1, HCRTR2, NPY5R SMN1; SMN2 3184/4885LMNA 3348/4885QPCT 3837/4885

“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.