SCHEMBL934749

SCHEMBL934749

Nc1ncc(-c2ccc(O)cc2)nc1-c1ccsc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATR Q13535 4/20 0.52
FYN P06241 1/20 0.46
PIK3CG P48736 2/20 0.46
LTA4H P09960 1/20 0.44
MKNK1 Q9BUB5 1/20 0.44
MKNK2 Q9HBH9 1/20 0.44
NEK2 P51955 3/20 0.43
PRKDC P78527 1/20 0.42
ATM Q13315 1/20 0.42
BCHE P06276 1/20 0.42
CYP2A6 P11509 1/20 0.41
ADK P55263 1/20 0.41
CHEK2 O96017 3/20 0.40
CHEK1 O14757 2/20 0.40
ASIC3 Q9UHC3 1/20 0.40
KCNH2 Q12809 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
SCHEMBL12198441 0.86 ATR (0.52) ATRNEK2CYP2A6ADKCHEK2
SCHEMBL6696482 0.85 PIK3CG (0.55) ATRPIK3CGLTA4HMKNK1MKNK2
SCHEMBL934795 0.79 ADORA1 (0.56) ATRPIK3CGPRKDCATMBCHE
SCHEMBL6701889 0.79 ADORA1 (0.56) ATRPIK3CGPRKDCATMBCHE
SCHEMBL6704802 0.77 PIK3CG (0.51) ATRPIK3CGNEK2PRKDCATM
SCHEMBL2506344 0.76 ATR (0.47) ATRNEK2CYP2A6ADKCHEK1
SCHEMBL934746 0.76 MAPT (0.51) ATRFYNPIK3CGLTA4HMKNK1
SCHEMBL2933060 0.75 KCNH2 (0.67) ATRMKNK1MKNK2CHEK1KCNH2
SCHEMBL2931488 0.74 NEK2 (0.64) ATRPIK3CGNEK2PRKDCATM
SCHEMBL2505631 0.72 ROCK1 (0.47) FYN

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
EP-2454261-B1 IMIDAZO[1,2-ALPHA]PYRAZIN-3(7H)-ONE DERIVATIVES BEARING A NEW ELECTRON-RICH STRUCTURE UNIV SIENA (IT) 2014-11-19 EP disclosed
US-8546147-B2 Imidazo[1,2-α]pyrazin-3(7H)-one derivatives bearing a new electron-rich structure UNIVERSITA DEGLI STUDI DI SIENA (IT) 2013-10-01 US disclosed
US-20120171703-A1 IMIDAZO[1,2-ALPHA]PYRAZIN-3(7H)-ONE DERIVATIVES BEARING A NEW ELECTRON-RICH STRUCTURE UNIVERSITÁ DEGLI STUDI DI SIENA (IT) 2012-07-05 US disclosed
EP-2454261-A1 IMIDAZO[1,2-ALPHA]PYRAZIN-3(7H)-ONE DERIVATIVES BEARING A NEW ELECTRON-RICH STRUCTURE Universita Degli Studi di Siena (IT) 2012-05-23 EP disclosed
WO-2011007314-A1 IMIDAZO[1,2-α]PYRAZIN-3(7H)-ONE DERIVATIVES BEARING A NEW ELECTRON-RICH STRUCTURE UNIVERSITÀ DEGLI STUDI DI SIENA (IT) 2011-01-20 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-20120171703-A1 IMIDAZO[1,2-ALPHA]PYRAZIN-3(7H)-ONE DERIVATIVES BEARING A NEW ELECTRON-RICH STRUCTURE GLB1, NDUFV1, IK ATR 4787/4885FYN 3907/4885PIK3CG 3127/4885

“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.