SCHEMBL6309762

SCHEMBL6309762

CC(C(=O)OCc1cccc(C(F)(F)F)c1)C(O)c1cccnc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.46
PRKCD Q05655 1/20 0.46
FFAR1 O14842 1/20 0.46
KCNA5 P22460 2/20 0.46
MMP1 P03956 1/20 0.44
MMP12 P39900 1/20 0.44
MAOB P27338 2/20 0.43
PTGES O14684 1/20 0.43
AKR1C3 P42330 1/20 0.43
VNN1 O95497 1/20 0.42
NR4A2 P43354 2/20 0.41
EPHX1 P07099 1/20 0.41
IDO1 P14902 1/20 0.41
NAMPT P43490 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL3062239 0.87 FFAR1 (0.47) PRKCAPRKCDFFAR1KCNA5MMP1
SCHEMBL3075533 0.85 FFAR1 (0.46) PRKCAPRKCDFFAR1KCNA5MMP1
SCHEMBL3069012 0.84 FFAR1 (0.47) PRKCAPRKCDFFAR1KCNA5MMP1
SCHEMBL3074108 0.84 FFAR1 (0.45) PRKCAPRKCDFFAR1KCNA5MMP1
SCHEMBL6309088 0.83 FFAR1 (0.45) PRKCAPRKCDFFAR1KCNA5MMP1
SCHEMBL13093725 0.82 FFAR1 (0.43) PRKCAPRKCDFFAR1KCNA5MMP1
SCHEMBL3062258 0.82 KCNA5 (0.45) PRKCAPRKCDFFAR1KCNA5MMP1
SCHEMBL13093728 0.82 FFAR1 (0.43) PRKCAPRKCDFFAR1KCNA5MMP1
SCHEMBL3061843 0.82 FFAR1 (0.43) PRKCAPRKCDFFAR1KCNA5MMP1
SCHEMBL3079305 0.82 FFAR1 (0.42) PRKCAPRKCDFFAR1KCNA5MMP1

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-20050277663-A1 3-Aryl-3-hydroxy-and 3-aryl-3-oxopropionic acid esters as fungicides ATP CAPITAL LP 2005-12-15 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-20050277663-A1 3-Aryl-3-hydroxy-and 3-aryl-3-oxopropionic acid esters as fungicides CYP21A2, HAO1, AHR PRKCA 3943/4885PRKCD 3870/4885FFAR1 222/4885

“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.