SCHEMBL10698968

SCHEMBL10698968

FC(F)(F)c1nc2nc3c(c([S])n2n1)CCCC3

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
PKM P14618 1/20 0.35
LMNA P02545 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK1 P28482 1/20 0.32
ALDH1A1 P00352 5/20 0.31
HSD17B10 Q99714 2/20 0.31
HPGD P15428 2/20 0.31
KMT2A Q03164 2/20 0.31
RAB9A P51151 2/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
ACHE P22303 1/20 0.31
NPC1 O15118 1/20 0.31
TSHR P16473 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
SCHEMBL10407299 0.83 KDM4E (0.36) KDM4EPKMLMNASMN1; SMN2L3MBTL1
SCHEMBL10408137 0.78 PKM (0.45) KDM4EPKMLMNAL3MBTL1MAPK1
SCHEMBL9822171 0.73 PKM (0.35) KDM4EPKMLMNAMAPK1ALDH1A1
SCHEMBL10407380 0.72 POLB (0.39) KDM4EPKMLMNAL3MBTL1MAPK1
SCHEMBL9822417 0.70 LMNA (0.35) KDM4EPKMLMNASMN1; SMN2L3MBTL1
SCHEMBL9822097 0.70 PKM (0.35) PKMLMNA
SCHEMBL10407269 0.68 LMNA (0.60) PKMLMNASMN1; SMN2L3MBTL1MAPK1
SCHEMBL10407681 0.68 ALDH1A1 (0.39) ALDH1A1KMT2A
SCHEMBL10397427 0.68 LMNA (0.33) KDM4EPKMLMNASMN1; SMN2MAPK1
SCHEMBL9822277 0.68 LMNA (0.39) KDM4EPKMLMNAALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0254495-A2 Beta-Lactam compound, method for preparing the same, medicinal composition for bacterially infectious disease therapy containing the same and intermediates for synthesis of the same SANKEI PHARMACEUTICAL COMPANY LIMITED (JP) 1988-01-27 EP disclosed