SCHEMBL10644589

SCHEMBL10644589

CCOC(=O)OC1=C(C)NC(C)=C(OC(=O)NC)C1c1ccccc1OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
TP53 P04637 2/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
BRD4 O60885 1/20 0.40
SIRT1 Q96EB6 1/20 0.39
KDM4E B2RXH2 2/20 0.39
HTT P42858 1/20 0.39
GAA P10253 2/20 0.38
TNKS2 Q9H2K2 1/20 0.38
ADORA3 P0DMS8 2/20 0.37
MAPT P10636 1/20 0.37
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL10647317 0.93 POLB (0.42) KMT2AMEN1TP53POLBSMN1; SMN2
SCHEMBL10644308 0.91 KMT2A (0.44) KMT2AMEN1TP53POLBSMN1; SMN2
SCHEMBL10649177 0.91 KDM4E (0.40) KMT2AMEN1TP53POLBSMN1; SMN2
SCHEMBL10649425 0.89 POLB (0.40) KMT2AMEN1TP53POLBSMN1; SMN2
SCHEMBL10914095 0.86 POLB (0.46) KMT2AMEN1TP53POLBSMN1; SMN2
SCHEMBL10647313 0.85 KDM4E (0.41) TP53POLBSMN1; SMN2KDM4EHTT
SCHEMBL10645304 0.85 POLB (0.41) KMT2AMEN1TP53POLBSMN1; SMN2
SCHEMBL10647011 0.85 HTR1A (0.39) KMT2AMEN1TP53BRD4KDM4E
SCHEMBL10644672 0.84 GAA (0.41) KMT2AMEN1TP53POLBSMN1; SMN2
SCHEMBL9691692 0.84 KMT2A (0.43) KMT2AMEN1TP53POLBSMN1; 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-0288758-A2 Dihydropyridinamides, process for their preparation and their use in medicines BAYER AG (DE) 1988-11-02 EP disclosed