SCHEMBL8196604

SCHEMBL8196604

O=C1CCN(c2nc[c]cn2)CC1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP2C19 P33261 1/20 0.31
MAPT P10636 1/20 0.31
HTR1A P08908 1/20 0.30
POLB P06746 1/20 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
SCHEMBL614756 0.78 KDM4E (0.52) LMNAKDM4EALDH1A1CYP2C19MAPT
SCHEMBL2037934 0.78 SMN1; SMN2 (0.40) LMNAKDM4EALDH1A1MAPTPOLB
SCHEMBL13717521 0.76 SMN1; SMN2 (0.40) KDM4EALDH1A1POLB
SCHEMBL12490138 0.73 GPR119 (0.42) LMNAALDH1A1POLB
SCHEMBL20244719 0.73 POLB (0.36) LMNAKDM4EALDH1A1MAPTPOLB
SCHEMBL12490123 0.73 GPR119 (0.43) LMNAKDM4EALDH1A1CYP2C19POLB
SCHEMBL18484646 0.73 PANK3 (0.43) LMNAKDM4EALDH1A1POLB
SCHEMBL4775116 0.73 LMNA (0.36) LMNA
SCHEMBL7086842 0.72 KDM4E (0.61) KDM4EALDH1A1CYP2C19HTR1APOLB
SCHEMBL1231550 0.72 POLB (0.50) LMNAKDM4EALDH1A1POLB

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
WO-2000023444-A1 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2000-04-27 WO claimed
WO-2000023444-A1 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2000-04-27 WO disclosed