SCHEMBL10907652

SCHEMBL10907652

O=C(Nc1ccc(C(=O)Nc2c(S(=O)(=O)O)cc3ccccc3c2O)cc1)C(=O)Nc1ccc(C(=O)Nc2c(S(=O)(=O)O)cc3ccccc3c2O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 2/20 0.42
PRMT3 O60678 1/20 0.42
EP300 Q09472 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
DEGS1 O15121 1/20 0.42
CD40 P25942 3/20 0.42
CD40LG P29965 3/20 0.42
ENPP2 Q13822 3/20 0.42
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
TIMP3 P35625 1/20 0.40
FGF1 P05230 1/20 0.40
HPGD P15428 1/20 0.40
CASP6 P55212 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
ING2 Q9H160 1/20 0.39
GPR27 Q9NS67 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TDP1 Q9NUW8 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
SCHEMBL11338609 0.93 PRMT1 (0.49) PRMT1PRMT3EP300PRMT6DEGS1
SCHEMBL10908400 0.90 DEGS1 (0.42) PRMT1PRMT3EP300PRMT6DEGS1
SCHEMBL8101954 0.89 CYP2D6 (0.47) PRMT1PRMT3EP300PRMT6ENPP2
SCHEMBL10907647 0.88 NPC1 (0.47) PRMT1KMT2AMEN1TIMP3NPC1
SCHEMBL11433104 0.86 CASP6 (0.48) PRMT1ENPP2KMT2AMEN1HPGD
SCHEMBL10907712 0.85 MPL (0.46) PRMT1DEGS1CD40CD40LGENPP2
SCHEMBL11337486 0.83 TIMP3 (0.47) PRMT1PRMT3EP300PRMT6DEGS1
SCHEMBL10905526 0.83 DHODH (0.44) PRMT1KMT2AMEN1TIMP3NPC1
SCHEMBL10908039 0.83 LMNA (0.40) PRMT1PRMT3EP300PRMT6ENPP2
SCHEMBL11425900 0.82 CD40 (0.54) PRMT1CD40CD40LGKMT2AMEN1

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-4599204-A Oxalylamides useful as dental antiplaque agents and inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1986-07-08 US disclosed