SCHEMBL6906606

SCHEMBL6906606

CC(=O)OCc1cc(F)c(F)cc1OC(C)=O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.45
CYP4A11 Q02928 2/20 0.45
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 4/20 0.38
MMP2 P08253 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
MMP12 P39900 1/20 0.38
CYP3A4 P08684 2/20 0.37
CA2 P00918 1/20 0.37
TNFSF11 O14788 1/20 0.36
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
RAB9A P51151 1/20 0.35
CFD P00746 2/20 0.35
HTT P42858 1/20 0.35
PTGS2 P35354 1/20 0.33

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
SCHEMBL44032 0.82 MMP2 (0.49) CYP4F2CYP4A11ALDH1A1KDM4EMMP2
SCHEMBL1901977 0.80 ALDH1A1 (0.45) CYP4F2CYP4A11ALDH1A1KDM4EMMP2
SCHEMBL6907476 0.77 CYP4F2 (0.43) CYP4F2CYP4A11ALDH1A1KDM4EMMP2
SCHEMBL6904042 0.77 NPSR1 (0.44) CYP4F2CYP4A11KDM4EPTGS2
SCHEMBL4842042 0.76 CYP3A4 (0.47) ALDH1A1KDM4EHSD17B10CYP3A4GAA
SCHEMBL24716315 0.75 CYP4F2 (0.42) CYP4F2CYP4A11ALDH1A1KDM4EMMP2
SCHEMBL344663 0.75 CYP4F2 (0.55) CYP4F2CYP4A11ALDH1A1KDM4EHSD17B10
SCHEMBL13034143 0.74 HSD17B10 (0.41) CYP4F2CYP4A11ALDH1A1KDM4EMMP2
SCHEMBL29140951 0.74 CYP4F2 (0.53) CYP4F2CYP4A11ALDH1A1KDM4EHSD17B10
SCHEMBL11308643 0.73 CFD (0.58) CYP4F2CYP4A11ALDH1A1KDM4EHSD17B10

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 196/4885ALDH1A1 1595/4885

“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.