SCHEMBL6802548

SCHEMBL6802548

COc1ccc(CCNC(=O)C(=COC(F)F)c2ccc(C(F)(F)F)cc2)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.51
ALDH1A1 P00352 8/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA9 Q16790 2/20 0.48
CA7 P43166 1/20 0.48
CA14 Q9ULX7 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
CA12 O43570 1/20 0.47
MAPT P10636 3/20 0.47
PPARD Q03181 1/20 0.47
PPARA Q07869 1/20 0.47
HPGD P15428 1/20 0.47
KDM4E B2RXH2 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
THRB P10828 1/20 0.47
PTGER1 P34995 1/20 0.46

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
SCHEMBL6806292 0.92 TMEM97 (0.50) GAAPPARDPPARA
SCHEMBL6806293 0.92 TMEM97 (0.50) GAAPPARDPPARA
SCHEMBL6802595 0.90 GAA (0.42) GAAALDH1A1CA1CA2CA9
SCHEMBL6802596 0.90 GAA (0.42) GAAALDH1A1CA1CA2CA9
SCHEMBL6801546 0.89 MAPT (0.58) GAAALDH1A1CA1CA2CA9
SCHEMBL6796855 0.89 ALDH1A1 (0.62) GAAALDH1A1CA1CA2CA9
SCHEMBL6796850 0.89 ALDH1A1 (0.62) GAAALDH1A1CA1CA2CA9
SCHEMBL6801543 0.89 MAPT (0.58) GAAALDH1A1CA1CA2CA9
SCHEMBL6802677 0.88 GAA (0.64) GAAALDH1A1CA1CA2CA9
SCHEMBL6801944 0.88 ALDH1A1 (0.58) GAAALDH1A1CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6762321-B2 SUCH AS N-(2-(3,4-DIMETHOXYPHENYL)ETHYL)-3-DIFLUOROMETHOXY-2-(4 -METHYLPHENYL)ACRYLAMIDE; FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-07-13 US disclosed
US-20030195354-A1 Amide compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-10-16 US disclosed
EP-1295868-A1 AMIDE COMPOUNDS AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-26 EP 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-20030195354-A1 Amide compounds and use thereof CBR1, CBR3, NAT1 GAA 2282/4885ALDH1A1 244/4885CA1 522/4885

“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.