SCHEMBL5012428

SCHEMBL5012428

O=C(OC1CCCCC1)C(COC1CCCCC1)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.37
EPHX1 P07099 2/20 0.37
CYP19A1 P11511 3/20 0.36
CYP2C19 P33261 1/20 0.35
NAAA Q02083 2/20 0.34
HTT P42858 1/20 0.33
GPR35 Q9HC97 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
KDM4E B2RXH2 1/20 0.30
TSHR P16473 1/20 0.30
CASP1 P29466 1/20 0.30

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
SCHEMBL5008329 1.00 L3MBTL1 (0.37) L3MBTL1EPHX1CYP19A1CYP2C19NAAA
SCHEMBL16467167 0.75 CYP19A1 (0.45) L3MBTL1EPHX1CYP19A1CYP2C19NAAA
SCHEMBL28112247 0.74 CYP19A1 (0.41) L3MBTL1EPHX1CYP19A1CYP2C19NAAA
SCHEMBL16467209 0.73 CYP19A1 (0.43) L3MBTL1EPHX1CYP19A1CYP2C19NAAA
SCHEMBL12704999 0.69 EPHX1 (0.45) L3MBTL1EPHX1CYP19A1CYP2C19NAAA
SCHEMBL12705000 0.69 EPHX1 (0.45) L3MBTL1EPHX1CYP19A1CYP2C19NAAA
SCHEMBL11991797 0.69 EPHX1 (0.45) L3MBTL1EPHX1CYP19A1CYP2C19NAAA
SCHEMBL21396853 0.69 L3MBTL1 (0.38) L3MBTL1EPHX1CYP19A1CYP2C19NAAA
SCHEMBL14748194 0.69 EPHX1 (0.41) L3MBTL1EPHX1CYP19A1CYP2C19NAAA
SCHEMBL14422659 0.68 EPHX1 (0.48) L3MBTL1EPHX1CYP19A1CYP2C19NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1637514-B1 METHOD FOR PRODUCING FLUORINE-CONTAINING ACRYLATE TOSOH F TECH INC (JP) 2014-05-07 EP disclosed
EP-1637514-B1 METHOD FOR PRODUCING FLUORINE-CONTAINING ACRYLATE TOSOH F TECH INC (JP) 2014-05-07 EP disclosed
US-7470808-B2 Method for producing fluorine-containing acrylate TOSOH F-TECH, INC. (JP) 2008-12-30 US disclosed
US-7470808-B2 Method for producing fluorine-containing acrylate TOSOH F-TECH, INC. (JP) 2008-12-30 US disclosed
US-7470808-B2 Method for producing fluorine-containing acrylate TOSOH F-TECH, INC. (JP) 2008-12-30 US disclosed
US-20060122423-A1 Method for producing fluorine-containing acrylate SAGAMI CHEMICAL RESEARCH CENTER (JP) 2006-06-08 US disclosed
EP-1637514-A1 METHOD FOR PRODUCING FLUORINE-CONTAINING ACRYLATE Tosoh F-Tech, Inc. (JP) 2006-03-22 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-20060122423-A1 Method for producing fluorine-containing acrylate AFF4, CBR1, AFF1 L3MBTL1 3198/4885EPHX1 1064/4885CYP19A1 1190/4885

“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.