SCHEMBL6794971

SCHEMBL6794971

O=C1CC(=O)N(c2ccc(Sc3ccccc3)cc2)C(=O)N1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 11/20 0.59
KMT2A Q03164 11/20 0.59
MAPT P10636 10/20 0.59
RAB9A P51151 1/20 0.55
HSD17B10 Q99714 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
POLB P06746 1/20 0.48
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.45
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
ALOX12 P18054 1/20 0.40
HPGD P15428 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
SCHEMBL125016 0.85 MEN1 (0.68) MEN1KMT2AMAPTRAB9AHSD17B10
SCHEMBL6799176 0.78 MAPT (0.68) MEN1KMT2AMAPTRAB9AHSD17B10
SCHEMBL20020500 0.75 MEN1 (0.69) MEN1KMT2AMAPTRAB9AHSD17B10
SCHEMBL125195 0.75 MAPT (1.00) MEN1KMT2AMAPTRAB9AHSD17B10
SCHEMBL8441345 0.75 MEN1 (1.00) MEN1KMT2AMAPTRAB9AHSD17B10
SCHEMBL28744558 0.75 MEN1 (0.69) MEN1KMT2AMAPTRAB9AHSD17B10
SCHEMBL8140377 0.74 MEN1 (0.63) MEN1KMT2AMAPTRAB9AHSD17B10
SCHEMBL11167414 0.73 MAPT (0.56) MEN1KMT2AMAPTRAB9AHSD17B10
SCHEMBL24156370 0.72 CRBN (0.73) MEN1KMT2AMAPTRAB9AMAOA
SCHEMBL10501019 0.72 MAOA (0.41) MEN1KMT2AMAPTRAB9ALMNA

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-6716845-B2 Barbituric acid derivatives HOFFMANN-LA ROCHE INC. 2004-04-06 US disclosed