SCHEMBL6907476

SCHEMBL6907476

CC(=O)OCc1c(OC(C)=O)cc(F)c(F)c1F

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.43
CYP4A11 Q02928 2/20 0.43
CA2 P00918 1/20 0.41
MMP1 P03956 4/20 0.36
MMP2 P08253 4/20 0.36
MMP9 P14780 3/20 0.36
MMP12 P39900 3/20 0.36
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 1/20 0.34
TNFSF11 O14788 1/20 0.34
MAOB P27338 1/20 0.34
ABCB1 P08183 1/20 0.34
CFD P00746 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.33
CYP3A4 P08684 1/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL4120091 0.81 MMP1 (0.46) CYP4F2CYP4A11CA2MMP1MMP2
SCHEMBL13034140 0.79 ALDH1A1 (0.42) CYP4F2CYP4A11CA2MMP1MMP2
SCHEMBL6902842 0.78 CYP4F2 (0.41) CYP4F2CYP4A11ALDH1A1CFDKDM4E
SCHEMBL31006941 0.77 CYP4F2 (0.47) CYP4F2CYP4A11ALDH1A1TDP1TNFSF11
SCHEMBL823844 0.77 CYP4F2 (0.47) CYP4F2CYP4A11ALDH1A1TDP1TNFSF11
SCHEMBL6906606 0.77 CYP4F2 (0.45) CYP4F2CYP4A11CA2MMP1MMP2
SCHEMBL44341 0.74 CA2 (0.46) CA2MMP1MMP2MMP9MMP12
SCHEMBL12474133 0.74 CYP4F2 (0.45) CYP4F2CYP4A11ALDH1A1TDP1TNFSF11
SCHEMBL4846023 0.73 PIM1 (0.43) CYP4F2CYP4A11CA2ALDH1A1TDP1
SCHEMBL7711877 0.73 CYP4F2 (0.44) CYP4F2CYP4A11ALDH1A1TDP1TNFSF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040171864-A1 Fluorinated aromatics LANXESS DEUTSCHLAND GMBH (DE) 2004-09-02 US claimed
US-20040171864-A1 Fluorinated aromatics LANXESS DEUTSCHLAND GMBH (DE) 2004-09-02 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-20040171864-A1 Fluorinated aromatics AFF1, AFF2, AFF4 CYP4F2 37/4885CYP4A11 196/4885CA2 2019/4885

“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.