SCHEMBL3934658

SCHEMBL3934658

CNC(=O)CCN(c1nc(Cl)ncc1Br)C(C)C.Clc1ncc(Br)c(Cl)n1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL3537452 0.95 ABL1 (0.35) ABL1BCRMEN1KMT2A
SCHEMBL3538730 0.85 ABL1 (0.33) ABL1BCRMEN1KMT2A
SCHEMBL3944499 0.85 MEN1 (0.31) ABL1BCRMEN1KMT2A
SCHEMBL3542239 0.80 MEN1 (0.34) ABL1BCRMEN1KMT2A
SCHEMBL3545008 0.80 MEN1 (0.33) ABL1BCRMEN1KMT2A
SCHEMBL3542118 0.79 MEN1 (0.33) ABL1BCRMEN1KMT2A
SCHEMBL3546180 0.78 MEN1 (0.43) MEN1KMT2A
SCHEMBL3541128 0.77 ABL1 (0.34) ABL1BCR
SCHEMBL3540225 0.74 IGF1R (0.32) MEN1KMT2A
SCHEMBL3539558 0.74 HDAC3 (0.38) ABL1BCRMEN1KMT2A

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
EP-2046793-A2 FUSED PYRIMIDO COMPOUNDS AstraZeneca AB (SE) 2009-04-15 EP disclosed
WO-2008003958-A2 FUSED PYRIMIDO COMPOUNDS ASTRAZENECA AB (SE) 2008-01-10 WO disclosed