SCHEMBL12410909

SCHEMBL12410909

CC(C)n1cnc(C(=O)N(C)C)n1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ADORA2A P29274 2/20 0.32
ADORA1 P30542 2/20 0.32
ADORA3 P0DMS8 1/20 0.32
RIPK1 Q13546 2/20 0.31
MGLL Q99685 1/20 0.31
DYRK1A Q13627 1/20 0.30
ACHE P22303 1/20 0.30
GCK P35557 2/20 0.30

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
SCHEMBL12924661 0.79 HCAR3 (0.36) ALDH1A1ADORA2AADORA1MGLLACHE
SCHEMBL784212 0.79 ACHE (0.33) ALDH1A1ADORA2AADORA1MGLLACHE
SCHEMBL784347 0.78 ADORA1 (0.40) ALDH1A1LMNAADORA2AADORA1MGLL
SCHEMBL2629297 0.76 ALDH1A1 (0.38) ALDH1A1LMNAKDM4ERIPK1MGLL
SCHEMBL12410701 0.75 BRD4 (0.36) RIPK1MGLLACHE
SCHEMBL12410700 0.75 NOTUM (0.46) ALDH1A1KDM4EMGLL
SCHEMBL12777993 0.72 POLB (0.40) LMNAMGLL
SCHEMBL12149907 0.72 LMNA (0.30) LMNA
SCHEMBL22040162 0.71 ADORA1 (0.45) LMNAKDM4EADORA2AADORA1ADORA3
SCHEMBL12410998 0.71 MGLL (0.33) ALDH1A1KDM4EMGLLACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130289013-A1 IMIDAZO[1,2-a]PYRIDINE COMPOUNDS SUNOVION PHARMACEUTICALS INC. 2013-10-31 US disclosed
US-20110166146-A1 IMIDAZO[1,2-a]PYRIDINE COMPOUNDS SUNOVION PHARMACEUTICALS INC. (US) 2011-07-07 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-20110166146-A1 IMIDAZO[1,2-a]PYRIDINE COMPOUNDS PAICS, ITPA, DPYD ALDH1A1 269/4885LMNA 2528/4885KDM4E 3088/4885
US-20130289013-A1 IMIDAZO[1,2-a]PYRIDINE COMPOUNDS PAICS, ITPA, DPYD ALDH1A1 269/4885LMNA 2528/4885KDM4E 3088/4885

“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.