SCHEMBL19587709

SCHEMBL19587709

O=C(NCc1cccc(CNC(=O)OCCN2C(=O)NC(=O)C(Cc3ccccc3)C2=O)c1)OCCN1CC(Cc2ccccc2)C(=O)NC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.41
ALDH1A1 P00352 4/20 0.37
PADI3 Q9ULW8 1/20 0.34
PADI4 Q9UM07 1/20 0.34
KMT2A Q03164 2/20 0.34
ADORA2A P29274 1/20 0.34
ADORA2B P29275 1/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CTSD P07339 1/20 0.34
BACE1 P56817 1/20 0.34
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
CMA1 P23946 1/20 0.33
LMNA P02545 2/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.32
RECQL P46063 1/20 0.32

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
SCHEMBL17864856 0.90 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1PADI3PADI4KMT2A
SCHEMBL18257385 0.76 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1KMT2AMEN1LMNA
SCHEMBL18257375 0.71 HDAC3 (0.39) ALDH1A1KMT2AMEN1IDO1TDO2
SCHEMBL17717907 0.70 EP300 (0.48) SMN1; SMN2ALDH1A1KMT2AMEN1LMNA
SCHEMBL18254504 0.69 EP300 (0.49) ALDH1A1KMT2AMEN1CYP3A4POLB
SCHEMBL20878123 0.68 IDO1 (0.34) SMN1; SMN2ALDH1A1KMT2AMEN1IDO1
SCHEMBL17717902 0.67 EP300 (0.56) ALDH1A1KMT2AMEN1CYP3A4CYP2C9
SCHEMBL17886028 0.66 TDP1 (0.38) SMN1; SMN2ALDH1A1KMT2AMEN1CYP3A4
SCHEMBL17717901 0.66 EP300 (0.50) ALDH1A1KMT2AMEN1POLBMAPT
SCHEMBL17552046 0.66 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1PADI3PADI4KMT2A

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-9817156-B2 Polarizing plate protective film, polarizing plate and display device FUJIFILM CORPORATION (JP) 2017-11-14 US disclosed