SCHEMBL2132979

SCHEMBL2132979

COC(=O)C(SCCC(F)(F)F)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
EPHX1 P07099 1/20 0.32
CA12 O43570 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL2137181 0.90 SMN1; SMN2 (0.32) SMN1; SMN2EPHX1CA1CA2
SCHEMBL2137212 0.89 SMN1; SMN2 (0.32) SMN1; SMN2EPHX1CA1CA2
SCHEMBL2138967 0.87 CYSLTR2 (0.32) SMN1; SMN2EPHX1CA1CA2
SCHEMBL2132570 0.87 CYSLTR2 (0.32) SMN1; SMN2EPHX1CA1CA2
SCHEMBL2134415 0.87 SMN1; SMN2 (0.32) SMN1; SMN2EPHX1
SCHEMBL2136914 0.85 ALDH1A1 (0.33) EPHX1
SCHEMBL2139235 0.85 EPHX1 (0.31) EPHX1
SCHEMBL2133758 0.83 AAK1 (0.38) EPHX1CA1CA2
SCHEMBL2137630 0.83 TSHR (0.37) SMN1; SMN2EPHX1
SCHEMBL2135203 0.82 SMN1; SMN2 (0.36) SMN1; SMN2EPHX1CA14CA1CA2

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 SMN1; SMN2 4843/4885EPHX1 2018/4885CA12 1582/4885

“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.