SCHEMBL30438335

SCHEMBL30438335

CC(=O)Nc1ccc(N=Nc2c(S(=O)(=O)O)cc3cc(S(=O)(=O)O)cc(NC(C)=O)c3c2O)cc1.[Na].[Na]

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 9/20 0.65
PRMT1 Q99873 2/20 0.61
PRMT3 O60678 1/20 0.61
EP300 Q09472 1/20 0.61
PRMT6 Q96LA8 1/20 0.61
CA2 P00918 1/20 0.57
CA3 P07451 1/20 0.57
FUT8 Q9BYC5 1/20 0.50
CD40 P25942 1/20 0.50
CD40LG P29965 1/20 0.50
PHLPP2 Q6ZVD8 1/20 0.46
MEN1 O00255 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 1/20 0.45
MAPK1 P28482 1/20 0.45
DNASE1L3 Q13609 1/20 0.45
NPC1 O15118 1/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL29678420 1.00 ENPP2 (0.65) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL3266745 1.00 ENPP2 (0.65) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL18135178 1.00 ENPP2 (0.65) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL30843979 0.93 PRMT1 (0.64) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL10050360 0.92 ENPP2 (0.68) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL12954923 0.92 ENPP2 (0.68) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL10620197 0.91 ENPP2 (0.67) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL2121247 0.91 ENPP2 (0.67) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL17746179 0.91 ENPP2 (0.67) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL29072445 0.90 ENPP2 (0.66) ENPP2PRMT1PRMT3EP300PRMT6

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
CN-116096585-A Firing solid drawing material 三菱铅笔株式会社 2023-05-09 CN disclosed