SCHEMBL2172917

SCHEMBL2172917

FC(F)(F)C1C[N]CCN1c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MAPK1 P28482 2/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
SIGMAR1 Q99720 2/20 0.33
NR1H2 P55055 2/20 0.32
NR1H3 Q13133 2/20 0.32
HPGD P15428 1/20 0.31
DCTPP1 Q9H773 1/20 0.31
ALOX5 P09917 1/20 0.30
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL2175936 0.74 MAPT (0.40) MAPTNPSR1MAPK1HTTSMN1; SMN2
SCHEMBL6865906 0.74 MAPK1 (0.44) MAPTNPSR1MAPK1HTTSMN1; SMN2
SCHEMBL21590289 0.70 HDAC1 (0.42) MAPTNPSR1MAPK1HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL17224424 0.70 MAPT (0.37) MAPTNPSR1MAPK1HTTSMN1; SMN2
SCHEMBL878133 0.70 SLC6A2 (0.53) SIGMAR1
SCHEMBL10909473 0.66 MAPT (0.35) MAPTNPSR1MAPK1HTTSMN1; SMN2
SCHEMBL42709 0.65 LMNA (0.54) MAPTNPSR1MAPK1HTTSMN1; SMN2
SCHEMBL2039410 0.65
SCHEMBL5541697 0.63 MAPT (0.41) MAPTNPSR1MAPK1HTTSMN1; SMN2
SCHEMBL7139562 0.61 MAPT (0.41) MAPTNPSR1MAPK1HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0049203-A1 Benzoxazolinones substituted in the 6-position by an amino-alcohol or amino-ketone chain, their preparation and their therapeutic use RIOM LABORATOIRES- C.E.R.M. (Société Anonyme) (FR) 1982-04-07 EP claimed
US-8853243-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2014-10-07 US disclosed
US-20110224189-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES INCYTE CORPORATION 2011-09-15 US disclosed
US-7973041-B2 Antiarthritic agents; psoriasis; anticancer agents;antiallergens; metalloprotease inhibitors. INCYTE CORPORATION (US) 2011-07-05 US disclosed
US-7491724-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2009-02-17 US disclosed
US-20080167288-A1 Substituted cyclic hydroxamates as lnhibitors of matrix metalloproteinases LNCYTE CORPORATION (US) 2008-07-10 US disclosed
US-20050113344-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION 2005-05-26 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 (3 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-20110224189-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES MMP25, MMP14, MMP9 MAPT 2590/4885NPSR1 1198/4885MAPK1 1676/4885
US-20080167288-A1 Substituted cyclic hydroxamates as lnhibitors of matrix metalloproteinases MMP25, MMP9, MMP24 MAPT 3223/4885NPSR1 1153/4885MAPK1 1558/4885
US-20050113344-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases MMP25, MMP2, MMP14 MAPT 2732/4885NPSR1 1141/4885MAPK1 1294/4885

“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.