SCHEMBL17047640

SCHEMBL17047640

CC1=CC(O)N(c2c(F)cccc2F)C1=O

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.35
AADAT Q8N5Z0 1/20 0.35
TRPA1 O75762 1/20 0.35
DAO P14920 2/20 0.33
PDE7A Q13946 2/20 0.32
FEN1 P39748 2/20 0.31
ALDH1A1 P00352 3/20 0.31
ALDH3A1 P30838 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
PDE7B Q9NP56 1/20 0.31
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31

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
SCHEMBL17047713 0.82 MEN1 (0.40) ALDH1A1GAA
SCHEMBL17047688 0.80 HTR7 (0.35) HTR7AADATTRPA1DAOPDE7A
SCHEMBL17047646 0.76 FAAH (0.42) ALDH1A1GAA
SCHEMBL17047801 0.75 RXFP1 (0.43) HTR7ALDH1A1
SCHEMBL17047790 0.74 RXFP1 (0.38) ALDH1A1GAA
SCHEMBL20320588 0.64
SCHEMBL20331352 0.61
SCHEMBL20313856 0.61
SCHEMBL21534348 0.61 ALDH1A1 (0.41) ALDH1A1
SCHEMBL20330657 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3110808-B1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-08-29 EP disclosed
US-9751867-B2 Plant growth regulating compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-09-05 US disclosed
EP-3110808-A1 PLANT GROWTH REGULATING COMPOUNDS Syngenta Participations AG (CH) 2017-01-04 EP disclosed
US-20160368900-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-12-22 US disclosed
WO-2015128321-A1 PLANT GROWTH REGULATING COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2015-09-03 WO 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-20160368900-A1 PLANT GROWTH REGULATING COMPOUNDS GHDC, GAK, EIF4G2 HTR7 3134/4885AADAT 3085/4885TRPA1 4699/4885

“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.