SCHEMBL5267481

SCHEMBL5267481

CC(C)NC(=O)c1n[nH]cc1NC(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 2/20 0.49
TP53 P04637 2/20 0.49
ALDH1A1 P00352 5/20 0.47
HPGD P15428 4/20 0.47
CYP1A2 P05177 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HTT P42858 2/20 0.46
POLB P06746 2/20 0.45
KMT2A Q03164 6/20 0.44
MEN1 O00255 3/20 0.44
PKM P14618 2/20 0.44
MAPT P10636 1/20 0.44
GRIK1 P39086 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA2B P29275 1/20 0.44
ADORA1 P30542 1/20 0.44
MDM2 Q00987 1/20 0.44
LMNA P02545 2/20 0.43

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
SCHEMBL5266131 0.92 LMNA (0.50) ALDH1A1HPGDCYP1A2SMN1; SMN2POLB
SCHEMBL5271746 0.90 ALDH1A1 (0.50) TP53ALDH1A1HPGDHTTKMT2A
SCHEMBL2801723 0.87 KMT2A (0.54) MDM4TP53HPGDCYP1A2HTT
SCHEMBL5266785 0.85 F10 (0.54) TP53ALDH1A1HPGDCYP1A2SMN1; SMN2
SCHEMBL5273753 0.84 MLYCD (0.49) HTTKMT2AMAPT
SCHEMBL5269232 0.83 CLK1 (0.49) POLBKMT2AMEN1PKM
SCHEMBL5265834 0.83 SIRT1 (0.53) HTTPOLBKMT2AMEN1ADORA3
SCHEMBL4287582 0.83 KDM4E (0.50) TP53ALDH1A1CYP1A2SMN1; SMN2HTT
SCHEMBL5272554 0.83 KMT2A (0.47) ALDH1A1CYP1A2SMN1; SMN2HTTPOLB
SCHEMBL4286877 0.81 PAX8 (0.56) MDM4TP53ALDH1A1HPGDSMN1; SMN2

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
EP-1847531-A1 PYRAZOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2007-10-24 EP disclosed