SCHEMBL2138758

SCHEMBL2138758

CCCCC(SCCCCC(C)(F)F)C(=O)OC(C)C

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
EPHX1 P07099 2/20 0.35
LMNA P02545 2/20 0.33
CTSK P43235 1/20 0.32
FAAH O00519 4/20 0.31
CES1 P23141 4/20 0.31
CES2 O00748 3/20 0.31
PLA2G6 O60733 1/20 0.31
LPAR1 Q92633 1/20 0.30
LPAR3 Q9UBY5 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
SCHEMBL2134758 0.99 EPHX1 (0.37) CA1CA2EPHX1LMNACTSK
SCHEMBL2136273 0.96 EPHX1 (0.37) CA1CA2EPHX1LMNAFAAH
SCHEMBL2139744 0.96 CA2 (0.37) CA1CA2EPHX1LMNACTSK
SCHEMBL2135586 0.95 EPHX1 (0.39) EPHX1LMNAFAAHCES1CES2
SCHEMBL2134711 0.93 EPHX1 (0.33) CA1CA2EPHX1LMNA
SCHEMBL2135940 0.92 LMNA (0.36) CA1CA2EPHX1LMNAFAAH
SCHEMBL2135667 0.92 EPHX1 (0.35) CA1CA2EPHX1LMNAFAAH
SCHEMBL2139757 0.90 EPHX1 (0.36) CA1CA2EPHX1LMNACTSK
SCHEMBL2133798 0.89 CA1 (0.36) CA1CA2EPHX1CTSKFAAH
SCHEMBL2136012 0.89 EPHX1 (0.38) CA1CA2EPHX1LMNACTSK

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 737/4885EPHX1 2018/4885

“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.