SCHEMBL6798746

SCHEMBL6798746

COc1cc(CCNC(=O)/C(=C\OC(F)F)c2ccc(Cl)cc2)ccc1O

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.53
ALDH1A1 P00352 1/20 0.53
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
NOX4 Q9NPH5 1/20 0.47
TYR P14679 1/20 0.47
ACHE P22303 1/20 0.47
CNR1 P21554 1/20 0.47
HDAC1 Q13547 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
MCHR1 Q99705 1/20 0.45

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
SCHEMBL6798948 1.00 GAA (0.53) GAAALDH1A1CA1CA2NOX4
SCHEMBL6798750 1.00 GAA (0.53) GAAALDH1A1CA1CA2NOX4
SCHEMBL6802680 0.92 GAA (0.64) GAAALDH1A1CA1CA2CNR1
SCHEMBL6802677 0.92 GAA (0.64) GAAALDH1A1CA1CA2CNR1
SCHEMBL6807150 0.92 CA1 (0.48) GAAALDH1A1CA1CA2NOX4
SCHEMBL6807148 0.92 CA1 (0.48) GAAALDH1A1CA1CA2NOX4
SCHEMBL6803651 0.91 NOX4 (0.48) NOX4TYRACHEHDAC1HDAC6
SCHEMBL6797880 0.91 ALDH1A1 (0.52) GAAALDH1A1CA1CA2NOX4
SCHEMBL6807707 0.91 MAPT (0.48) ALDH1A1CA1CA2NOX4TYR
SCHEMBL6803649 0.91 NOX4 (0.48) NOX4TYRACHEHDAC1HDAC6

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.