SCHEMBL7008953

SCHEMBL7008953

O=c1ccn2c(n1)NCCC2

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
KDM4E B2RXH2 4/20 0.42
POLB P06746 1/20 0.42
HPGD P15428 3/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPK10 P53779 1/20 0.38
GAA P10253 1/20 0.34
PARP1 P09874 1/20 0.34
MAPT P10636 1/20 0.33
GFER P55789 2/20 0.33
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
RAB9A P51151 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NTRK1 P04629 1/20 0.31

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
SCHEMBL2784363 0.71
Hydrochloric Acid SCHEMBL21121451 0.69 GFER (0.36) ALDH1A1KDM4EPOLBGFER
SCHEMBL2608598 0.67 UHRF1 (0.37) ALDH1A1KDM4EPOLBHPGDHSD17B10
SCHEMBL9570028 0.67 KDM4E (0.35) ALDH1A1KDM4EPOLBHPGDHSD17B10
SCHEMBL19514974 0.67 KDM4E (0.35) ALDH1A1KDM4EPOLBHPGDHSD17B10
SCHEMBL4769855 0.66 KDM4E (0.38) ALDH1A1KDM4EPOLBHPGDHSD17B10
Acetic Acid SCHEMBL3844358 0.66 KDM4E (0.34) ALDH1A1KDM4EPOLBHPGDHSD17B10
SCHEMBL11213762 0.66 ALDH1A1 (0.41) ALDH1A1KDM4EPOLBHPGDHSD17B10
SCHEMBL16387194 0.63 KDM4E (0.32) ALDH1A1KDM4EPOLBGFERRAB9A
SCHEMBL9597366 0.63 KDM4E (0.32) ALDH1A1KDM4EPOLBGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1340758-A1 Heteroaryl substituted 2-pyridinyl-6,7,8,9-tetrahydropyrimido[1,2-a]pyrimidin-4-one and 7-pyridinyl-2,3-dihydroimidazo[1,2-a]pyrimidin-5(1H)one derivatives SANOFI-SYNTHELABO (FR) 2003-09-03 EP claimed
EP-1184383-A1 9-[Alkyl], 9-[(heteroaryl)alkyl] and 9-[(aryl)alkyl]-2-pyridinyl-6,7,8,9-tetrahydropyrimido[1,2-a]pyrimidin-4-one derivatives SANOFI-SYNTHELABO (FR) 2002-03-06 EP claimed
EP-1340758-A1 Heteroaryl substituted 2-pyridinyl-6,7,8,9-tetrahydropyrimido[1,2-a]pyrimidin-4-one and 7-pyridinyl-2,3-dihydroimidazo[1,2-a]pyrimidin-5(1H)one derivatives SANOFI-SYNTHELABO (FR) 2003-09-03 EP disclosed
EP-1184383-A1 9-[Alkyl], 9-[(heteroaryl)alkyl] and 9-[(aryl)alkyl]-2-pyridinyl-6,7,8,9-tetrahydropyrimido[1,2-a]pyrimidin-4-one derivatives SANOFI-SYNTHELABO (FR) 2002-03-06 EP disclosed