SCHEMBL13583564

SCHEMBL13583564

CCc1ccc(C)cc1S(=O)(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.52
▸ TDP1 Q9NUW8 2/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ NHERF1 O14745 1/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ CCR2 P41597 3/20 0.47
▸ MCL1 Q07820 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.45
▸ LMNA P02545 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ KCNMA1 Q12791 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.44
▸ APP P05067 1/20 0.43
▸ CRHBP P24387 1/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ CMA1 P23946 1/20 0.43
▸ TSHR P16473 1/20 0.42

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
SCHEMBL6553599 0.81 MAPT (0.64) MAPTTDP1L3MBTL1SMN1; SMN2POLB
SCHEMBL6554561 0.81 MAPT (0.64) MAPTTDP1L3MBTL1SMN1; SMN2POLB
SCHEMBL6554557 0.80 MAPT (0.62) MAPTTDP1L3MBTL1SMN1; SMN2POLB
SCHEMBL6553303 0.78 MAPT (0.54) MAPTTDP1L3MBTL1SMN1; SMN2POLB
SCHEMBL6553223 0.76 MAPT (0.59) MAPTTDP1L3MBTL1SMN1; SMN2POLB
SCHEMBL26906943 0.74 MAPT (0.70) MAPTTDP1L3MBTL1SMN1; SMN2POLB
SCHEMBL29507647 0.72 MAPT (0.69) MAPTL3MBTL1SMN1; SMN2POLBCCR2
SCHEMBL1138740 0.72 MAPT (0.69) MAPTL3MBTL1SMN1; SMN2POLBCCR2
SCHEMBL357928 0.72 PDK1 (0.55) MAPTTDP1L3MBTL1SMN1; SMN2POLB
SCHEMBL27182938 0.71 L3MBTL1 (0.55) MAPTTDP1L3MBTL1SMN1; SMN2POLB

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-20120283216-A1 FUNGICIDAL 2-(BICYCLIC ARYLOXY)CARBOXAMIDES E. I. DU PONT DE NEMOURS AND COMPANY 2012-11-08 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120283216-A1 FUNGICIDAL 2-(BICYCLIC ARYLOXY)CARBOXAMIDES CBR3, CBR1, Q6ZSR9 MAPT 4750/4885TDP1 2075/4885L3MBTL1 861/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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