SCHEMBL11229948

SCHEMBL11229948

O=C1C=CC(=O)N1N1C(=O)c2ccccc2C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.54
KMT2A Q03164 3/20 0.47
ELANE P08246 1/20 0.44
TLR9 Q9NR96 1/20 0.42
MGLL Q99685 2/20 0.42
GAA P10253 1/20 0.42
EHMT2 Q96KQ7 2/20 0.42
EHMT1 Q9H9B1 2/20 0.42
CDC25B P30305 2/20 0.42
IDO1 P14902 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
AKT1 P31749 1/20 0.42
SNCA P37840 1/20 0.42
MAP2K1 Q02750 1/20 0.42
PIN1 Q13526 1/20 0.42
NSD1 Q96L73 1/20 0.42
CASP3 P42574 2/20 0.41
CYP1A2 P05177 1/20 0.40
MEN1 O00255 2/20 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
SCHEMBL454827 0.87 POLB (0.67) POLBKMT2AELANEGAAEHMT2
SCHEMBL2022462 0.84 POLB (0.64) POLBKMT2AELANEGAAEHMT2
SCHEMBL28160078 0.84 POLB (0.64) POLBKMT2AELANEGAAEHMT2
SCHEMBL11240803 0.75 TLR9 (0.48) POLBKMT2ATLR9MGLLMEN1
SCHEMBL157324 0.74 MGLL (0.50) POLBTLR9MGLLMAOAMAOB
SCHEMBL12464402 0.73 POLB (0.52) POLBKMT2AELANEGAAEHMT2
SCHEMBL3992123 0.73 POLB (0.52) POLBKMT2AELANEGAAEHMT2
SCHEMBL1965970 0.70 POLB (1.00) POLBKMT2AELANEGAAEHMT2
SCHEMBL13896437 0.70 POLB (0.54) POLBKMT2AELANEGAAEHMT2
SCHEMBL30022123 0.70 POLB (0.54) POLBKMT2AELANEGAAEHMT2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4365068-A Crosslinkable bis-imidyl derivatives CIBA-GEIGY CORPORATION (US) 1982-12-21 US disclosed
US-4280946-A Crosslinkable bis-imidyl derivatives CIBA-GEIGY CORPORATION (US) 1981-07-28 US disclosed
US-4219481-A Crosslinkable bis-imidyl derivatives CIBA-GEIGY CORPORATION (US) 1980-08-26 US disclosed
US-4126619-A CROSSLINKABLE BIS-IMIDYL DERIVATIVES CIBA-GEIGY CORPORATION (US) 1978-11-21 US disclosed