SCHEMBL2136297

SCHEMBL2136297

CCCCC(SCCCC(F)(F)CCC)C(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
ZDHHC7 Q9NXF8 1/20 0.36
HDAC2 Q92769 1/20 0.32
EPHX1 P07099 1/20 0.32
USP2 O75604 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.31
PDF Q9HBH1 1/20 0.31
CTSK P43235 2/20 0.30
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
CES1 P23141 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
SCHEMBL2134840 0.96 ZDHHC7 (0.41) CA1CA2ZDHHC7EPHX1USP2
SCHEMBL2134033 0.93 CA1 (0.38) CA1CA2ZDHHC7
SCHEMBL2133652 0.92 CA1 (0.44) CA1CA2ZDHHC7HDAC2EPHX1
SCHEMBL2132709 0.89 CA1 (0.34) CA1CA2EPHX1CES1
SCHEMBL2133573 0.89 CA1 (0.46) CA1CA2ZDHHC7HDAC2EPHX1
SCHEMBL2135362 0.88 CA1 (0.33) CA1CA2EPHX1
SCHEMBL2134184 0.88 ALDH1A1 (0.34) CA1CA2EPHX1
SCHEMBL2135915 0.88 CA1 (0.43) CA1CA2ZDHHC7HDAC2EPHX1
SCHEMBL2136256 0.88 LMNA (0.33) CA1CA2EPHX1LMNACTSK
SCHEMBL2135153 0.88 ZDHHC7 (0.41) CA1CA2ZDHHC7EPHX1USP2

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 CA1 617/4885CA2 737/4885ZDHHC7 475/4885

“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.