SCHEMBL20048205

SCHEMBL20048205

COC(O)c1nonc1NC(=O)CN/C=N\N=N

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
RECQL P46063 1/20 0.30
KMT2A Q03164 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL20048219 0.60 STAT5B (0.44)
SCHEMBL10507412 0.50 POLB (0.45) MEN1RECQLKMT2AHSD17B10
SCHEMBL10507431 0.49 ALDH1A1 (0.49) MEN1RECQLKMT2AHSD17B10
SCHEMBL13870132 0.48 SMN1; SMN2 (0.59) MEN1RECQLKMT2AHSD17B10
SCHEMBL21592078 0.46 MEN1 (0.54) MEN1KMT2A
SCHEMBL3051391 0.45 POLB (0.55) MEN1KMT2A
SCHEMBL10809929 0.45 SMN1; SMN2 (0.51) MEN1RECQLKMT2AHSD17B10
SCHEMBL17966743 0.45
SCHEMBL31530780 0.44 LMNA (0.31)
SCHEMBL10504942 0.44 TSHR (0.51) KMT2AHSD17B10

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-2018065536-A1 NOVEL FURAZAN-3-CARBOXYLIC ACID DERIVATIVES AND USE THEREOF IN TREATMENT OF CANCER FREIE UNIVERSITÄT BERLIN (DE) 2018-04-12 WO disclosed