SCHEMBL11054293

SCHEMBL11054293

CCN(CC)c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.72
MAPK13 O15264 9/20 0.60
MAPK12 P53778 9/20 0.60
MAPK11 Q15759 9/20 0.60
MAPK14 Q16539 9/20 0.60
GCGR P47871 4/20 0.60
RAF1 P04049 4/20 0.58
MAPK9 P45984 1/20 0.57
KDM4E B2RXH2 2/20 0.56
ALDH1A1 P00352 2/20 0.56
GLA P06280 2/20 0.56
GAA P10253 2/20 0.56
HPGD P15428 2/20 0.56
KMT2A Q03164 2/20 0.56
MAPT P10636 4/20 0.55
TP53 P04637 3/20 0.53
BRAF P15056 2/20 0.53
ALOX5 P09917 1/20 0.53
MEN1 O00255 1/20 0.53

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
SCHEMBL1071183 0.84 NOX1 (1.00) NOX1MAPK13MAPK12MAPK11MAPK14
SCHEMBL5074753 0.83 MAPK13 (0.83) NOX1MAPK13MAPK12MAPK11MAPK14
SCHEMBL16667652 0.81 MAPK13 (0.83) NOX1MAPK13MAPK12MAPK11MAPK14
Benzene SCHEMBL28852698 0.81 MAPK13 (0.82) NOX1MAPK13MAPK12MAPK11MAPK14
SCHEMBL104130 0.81 MAPK13 (0.82) NOX1MAPK13MAPK12MAPK11MAPK14
SCHEMBL1170567 0.80 NT5E (0.70) NOX1MAPK13MAPK12MAPK11MAPK14
SCHEMBL27850480 0.79 MAPK13 (0.79) NOX1MAPK13MAPK12MAPK11MAPK14
Methane SCHEMBL3278320 0.79 MAPK13 (0.79) NOX1MAPK13MAPK12MAPK11MAPK14
SCHEMBL14446725 0.79 MAPT (0.48) NOX1MAPK13MAPK12MAPK11MAPK14
SCHEMBL23710761 0.79 KDM4E (0.78) NOX1MAPK13MAPK12MAPK11MAPK14

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-4431722-A POLYCYCLIC QUINONE PIGMENT DISPERSED IN A RESIN BINDER AS CHARGE GENERATING LAYER; ANTIFOGGING AGENTS KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1984-02-14 US disclosed