SCHEMBL10646407

SCHEMBL10646407

COC(=O)OC1=C(C)NC(C)=C(OC(=O)N[C@H](CO)C(C)C)C1c1ccccc1OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
GAA P10253 1/20 0.39
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NR1I2 O75469 1/20 0.36
BRD4 O60885 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
TRPV3 Q8NET8 1/20 0.35
GPBAR1 Q8TDU6 1/20 0.35
TP53 P04637 1/20 0.35
HTT P42858 1/20 0.34
PTPN1 P18031 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL10648208 0.91 BRD4 (0.39) KDM4EGAAPOLBSMN1; SMN2NR1I2
SCHEMBL10914095 0.88 POLB (0.46) KDM4EGAAPOLBSMN1; SMN2NR1I2
SCHEMBL10644333 0.87 TRPM8 (0.43) KDM4EGAAPOLBSMN1; SMN2NR1I2
SCHEMBL10645587 0.87 TRPM8 (0.43) KDM4EGAAPOLBSMN1; SMN2NR1I2
SCHEMBL10646822 0.87 TRPM8 (0.43) KDM4EGAAPOLBSMN1; SMN2NR1I2
SCHEMBL10647317 0.86 POLB (0.42) KDM4EGAAPOLBSMN1; SMN2NR1I2
SCHEMBL10647525 0.85 SMN1; SMN2 (0.38) KDM4EGAAPOLBSMN1; SMN2NR1I2
SCHEMBL9691359 0.85 POLB (0.44) KDM4EGAAPOLBSMN1; SMN2NR1I2
SCHEMBL10651042 0.84 BRD4 (0.41) KDM4EGAAPOLBSMN1; SMN2NR1I2
SCHEMBL10647279 0.84 NPC1 (0.43) KDM4EGAAPOLBSMN1; SMN2NR1I2

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