SCHEMBL20280946

SCHEMBL20280946

CCCNc1nc(N)c2cc(OC)c(OC)cc2n1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 7/20 0.56
MAPT P10636 7/20 0.56
POLB P06746 4/20 0.56
BLM P54132 2/20 0.56
RAD52 P43351 2/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
MITF O75030 1/20 0.54

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
SCHEMBL23260498 0.89 EHMT2 (0.62) TP53MAPTPOLBBLM
SCHEMBL30526270 0.89 TP53 (0.56) TP53MAPTPOLBBLMRAD52
SCHEMBL10837757 0.89 TP53 (0.56) TP53MAPTPOLBBLMRAD52
SCHEMBL8758459 0.84 NPY1R (0.56) TP53MAPTPOLBBLM
SCHEMBL13901840 0.80 TP53 (0.63) TP53MAPTPOLBBLMRAD52
SCHEMBL14564131 0.79 KDM1A (0.58) POLBKMT2A
SCHEMBL26530734 0.78 EHMT2 (0.67)
SCHEMBL6785331 0.76 TP53 (0.52) TP53MAPTPOLBBLMMEN1
SCHEMBL6781777 0.75 TP53 (0.50) TP53MAPTPOLBBLMMEN1
SCHEMBL8757881 0.75 TP53 (0.48) TP53MAPTPOLBBLMRAD52

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-2018107200-A1 HEPARANASE INHIBITORS AND USE THEREOF Beta Therapeutics Pty Ltd (AU) 2018-06-21 WO disclosed