SCHEMBL11408774

SCHEMBL11408774

O=[N+]([O-])c1ccc(Nc2ccccc2Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.62
▸ HPGD P15428 1/20 0.62
▸ ALOX12 P18054 1/20 0.62
▸ CXCR2 P25025 1/20 0.54
▸ MAPK1 P28482 5/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ HTT P42858 3/20 0.53
▸ LMNA P02545 1/20 0.53
▸ KMT2A Q03164 9/20 0.52
▸ GAA P10253 3/20 0.52
▸ MEN1 O00255 6/20 0.50
▸ MAPT P10636 5/20 0.50
▸ TDP1 Q9NUW8 3/20 0.50
▸ GFER P55789 1/20 0.50
▸ CASP7 P55210 1/20 0.50
▸ C1R P00736 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ GLA P06280 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL5718635 0.81 MAPK1 (0.77) L3MBTL1HPGDALOX12CXCR2MAPK1
SCHEMBL15902994 0.80 MAPT (0.68) L3MBTL1HPGDALOX12CXCR2MAPK1
SCHEMBL8765310 0.79 MAPT (0.67) L3MBTL1HPGDALOX12CXCR2MAPK1
SCHEMBL11025851 0.79 L3MBTL1 (0.62) L3MBTL1HPGDALOX12CXCR2MAPK1
SCHEMBL30499873 0.79 L3MBTL1 (0.62) L3MBTL1HPGDALOX12CXCR2MAPK1
SCHEMBL27981277 0.79 MAPK1 (0.56) L3MBTL1HPGDCXCR2MAPK1ALDH1A1
SCHEMBL27502873 0.78 MAPT (0.69) L3MBTL1HPGDMAPK1ALDH1A1HTT
SCHEMBL9479463 0.77 ALOX12 (1.00) L3MBTL1HPGDALOX12CXCR2MAPK1
SCHEMBL224794 0.77 ALOX12 (1.00) L3MBTL1HPGDALOX12CXCR2MAPK1
SCHEMBL28394607 0.77 ALDH1A1 (0.61) L3MBTL1HPGDALOX12CXCR2MAPK1

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-4187248-A FORMANILIDE MONSANTO COMPANY (US) 1980-02-05 — — US disclosed
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