SCHEMBL5866780

SCHEMBL5866780

CC1COC(CN(C)C)CN1c1ccc2nc(-c3n[nH]c4c(NC(=O)C(C)(C)C)cccc34)[nH]c2c1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 6/20 0.39
FGFR1 P11362 4/20 0.38
FLT1 P17948 4/20 0.38
FLT3 P36888 6/20 0.38
ABL1 P00519 2/20 0.37
BCR P11274 2/20 0.37
RAF1 P04049 2/20 0.35
BRAF P15056 2/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL3532552 0.92 PDPK1 (0.40) PDPK1FGFR1FLT1FLT3ABL1
SCHEMBL5866757 0.90 FGFR1 (0.48) PDPK1FGFR1FLT1FLT3ABL1
SCHEMBL5866797 0.87 PDPK1 (0.51) PDPK1FGFR1FLT1FLT3ABL1
SCHEMBL5866785 0.87 PDPK1 (0.44) PDPK1FGFR1FLT1FLT3ABL1
SCHEMBL3536048 0.86 PDPK1 (0.38) PDPK1FGFR1FLT1FLT3ABL1
SCHEMBL3538825 0.86 FOXO1 (0.39) PDPK1FGFR1FLT1FLT3ABL1
SCHEMBL3535987 0.86 MAPT (0.38) PDPK1FGFR1FLT1FLT3ABL1
SCHEMBL5866691 0.84 FGFR1 (0.40) PDPK1FGFR1FLT1FLT3ABL1
SCHEMBL3539088 0.83 FGFR1 (0.39) PDPK1FGFR1FLT1FLT3ABL1
SCHEMBL3538875 0.82 PDPK1 (0.49) PDPK1FGFR1FLT1FLT3ABL1

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
US-7064215-B2 Indazole benzimidazole compounds CHIRON CORPORATION (US) 2006-06-20 US disclosed