SCHEMBL2136553

SCHEMBL2136553

CCCCCC(SCCCC(F)(F)C(F)F)C(=O)OCC

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
EPHX2 P34913 2/20 0.32
NOD1 Q9Y239 1/20 0.31
ZDHHC7 Q9NXF8 1/20 0.31
EPHX1 P07099 1/20 0.31
ALOX5 P09917 3/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTGES O14684 1/20 0.31
FAAH O00519 4/20 0.31
CES1 P23141 4/20 0.31
CES2 O00748 2/20 0.31
PLA2G6 O60733 1/20 0.31

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
SCHEMBL2137959 0.96 CA1 (0.33) EPHX1ALOX5PTGES
SCHEMBL2133934 0.92
SCHEMBL2135881 0.91 MAPT (0.36) MAPTZDHHC7EPHX1FAAHCES1
SCHEMBL2135998 0.91 MAPT (0.36) MAPTZDHHC7EPHX1ALOX5ATM
SCHEMBL2136109 0.90 MAPT (0.32) MAPTEPHX2NOD1ZDHHC7EPHX1
SCHEMBL2134448 0.90 ZDHHC7 (0.40) MAPTZDHHC7EPHX1MEN1KMT2A
SCHEMBL2131308 0.89 EPHX1 (0.32) MAPTEPHX1
SCHEMBL2134690 0.88 LMNA (0.35) MAPTZDHHC7EPHX1FAAHCES1
SCHEMBL2132854 0.88 ZDHHC7 (0.33) MAPTEPHX2NOD1ZDHHC7EPHX1
SCHEMBL2140975 0.87 MAPT (0.32) MAPTZDHHC7EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2664613-A1 Process for producing amide compounds Sumitomo Chemical Company, Limited (JP) 2013-11-20 EP disclosed
EP-2662355-A1 Process for producing a (fluoroalkylthio) acetonitrile Sumitomo Chemical Company, Limited (JP) 2013-11-13 EP disclosed
EP-2465846-A1 PROCESS FOR PREPARATION OF (FLUOROALKYLTHIO)ACETIC ACID ESTERS Sumitomo Chemical Company, Limited (JP) 2012-06-20 EP disclosed
US-20120101294-A1 PROCESS FOR PRODUCING (FLUOROALKYLTHIO) ACETIC ACID ESTER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-26 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-20120101294-A1 PROCESS FOR PRODUCING (FLUOROALKYLTHIO) ACETIC ACID ESTER GRHPR, AKR7A2, FAR1 MAPT 4195/4885EPHX2 1665/4885NOD1 2016/4885

“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.