SCHEMBL8907435

SCHEMBL8907435

CCN(CC)CCCNc1nc(Cl)nc2c(C)cc(C)cc12

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.44
TOP2A P11388 1/20 0.44
FLT3 P36888 11/20 0.42
POLB P06746 1/20 0.42
TP53 P04637 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 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
Hydrochloric Acid SCHEMBL8907581 0.99 POLB (0.44) SLC2A1TOP2AFLT3POLBTP53
SCHEMBL8906085 0.73 SLC2A1 (0.71) SLC2A1TOP2AFLT3POLBALDH1A1
SCHEMBL8907203 0.73 FLT3 (0.50) SLC2A1TOP2AFLT3POLBKDM4E
Hydrochloric Acid SCHEMBL8891454 0.72 POLB (0.72) SLC2A1TOP2AFLT3POLBALDH1A1
SCHEMBL4874795 0.68 KMT2A (0.57) SLC2A1TOP2ALMNAMAPTGAA
SCHEMBL21230580 0.68 ELANE (0.54) SLC2A1POLBTP53KDM4EALDH1A1
SCHEMBL18124747 0.66 SLC29A1 (0.42) KDM4E
SCHEMBL4172267 0.66 PARP1 (0.44) POLBLMNAMAPTKDM4EALDH1A1
SCHEMBL8907169 0.65 APP (0.62) SLC2A1TOP2AFLT3POLBGAA
SCHEMBL8908237 0.65 KDM4E (0.46) SLC2A1TOP2AFLT3POLBMAPT

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
WO-1997020823-A2 2-AMINO QUINAZOLINE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 1997-06-12 WO disclosed