SCHEMBL17020484

SCHEMBL17020484

O=c1[nH]c(=O)c2cc3c(=O)n(-c4ccc(I)cc4)c(=O)c3cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.46
CA1 P00915 5/20 0.46
CA2 P00918 5/20 0.46
CA9 Q16790 5/20 0.46
FAAH O00519 1/20 0.37
MGLL Q99685 1/20 0.37
MAPK1 P28482 1/20 0.37
KDM4E B2RXH2 4/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
LMNA P02545 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPT P10636 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
TP53 P04637 2/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL11148295 0.84 CA12 (0.47) CA12CA1CA2CA9MGLL
SCHEMBL25095011 0.82 HPGD (0.47) CA12CA1CA2CA9MGLL
SCHEMBL26784976 0.82 CA12 (0.46) CA12CA1CA2CA9MAPK1
SCHEMBL23876300 0.82 ALDH1A1 (0.51) CA12CA1CA2CA9MAPK1
SCHEMBL2780901 0.81 MAPK1 (0.59) CA12CA1CA2CA9MAPK1
SCHEMBL13863616 0.79 CA12 (0.44) CA12CA1CA2CA9MAPK1
SCHEMBL6675514 0.78 CA12 (0.65) CA12CA1CA2CA9MAPK1
SCHEMBL11131226 0.76 NTRK1 (0.55) CA12CA1CA2CA9MGLL
SCHEMBL11134130 0.76 NPC1 (0.48) CA12CA1CA2CA9MAPK1
SCHEMBL797037 0.75 FAAH (0.43) CA12CA1CA2CA9FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9250547-B2 Intermediate transfer members and processes XEROX CORPORATION (US) 2016-02-02 US disclosed
US-20150234299-A1 INTERMEDIATE TRANSFER MEMBERS AND PROCESSES XEROX CORPORATION (US) 2015-08-20 US disclosed