SCHEMBL2139744

SCHEMBL2139744

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

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.37
CA1 P00915 2/20 0.37
LMNA P02545 2/20 0.34
CTSK P43235 2/20 0.33
EPHX1 P07099 2/20 0.33
CES1 P23141 1/20 0.30
MAPK1 P28482 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
SCHEMBL2135940 0.96 LMNA (0.36) CA2CA1LMNAEPHX1CES1
SCHEMBL2138758 0.96 CA1 (0.36) CA2CA1LMNACTSKEPHX1
SCHEMBL2134758 0.95 EPHX1 (0.37) CA2CA1LMNACTSKEPHX1
SCHEMBL2138713 0.93 LMNA (0.32) CA2CA1LMNAEPHX1
SCHEMBL2136273 0.92 EPHX1 (0.37) CA2CA1LMNAEPHX1CES1
SCHEMBL2135586 0.91 EPHX1 (0.39) LMNAEPHX1CES1
SCHEMBL2139546 0.90 LMNA (0.35) CA2CA1LMNACTSKEPHX1
SCHEMBL2134711 0.89 EPHX1 (0.33) CA2CA1LMNAEPHX1
SCHEMBL2134919 0.89 CA1 (0.37) CA2CA1CTSKEPHX1CES1
SCHEMBL2133603 0.88 LMNA (0.33) CA2CA1LMNACTSKEPHX1

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 CA2 737/4885CA1 617/4885LMNA 4769/4885

“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.