SCHEMBL2137201

SCHEMBL2137201

CC(C)CC(SCCCCC(F)(F)F)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.33
CYSLTR1 Q9Y271 1/20 0.33
RNPEP Q9H4A4 1/20 0.32
SLC7A5 Q01650 1/20 0.32
EPHX1 P07099 2/20 0.32
FOLH1 Q04609 1/20 0.31
CTSS P25774 1/20 0.31
CTSK P43235 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
SCHEMBL2134546 0.98 CYSLTR2 (0.35) CYSLTR2CYSLTR1RNPEPSLC7A5EPHX1
SCHEMBL2133156 0.98 CYSLTR2 (0.35) CYSLTR2CYSLTR1RNPEPSLC7A5EPHX1
SCHEMBL2136076 0.95 RNPEP (0.33) CYSLTR2CYSLTR1RNPEPSLC7A5EPHX1
SCHEMBL2133644 0.89 RNPEP (0.32) RNPEPSLC7A5EPHX1FOLH1
SCHEMBL2133570 0.88 RNPEP (0.35) RNPEPSLC7A5EPHX1FOLH1CTSS
SCHEMBL2133742 0.88 RNPEP (0.31) RNPEPSLC7A5EPHX1FOLH1
SCHEMBL2134074 0.88 EPHX1 (0.32) RNPEPSLC7A5EPHX1FOLH1
SCHEMBL2131678 0.86 EPHX1 (0.31) RNPEPSLC7A5EPHX1
SCHEMBL2137016 0.86 EPHX1 (0.31) RNPEPSLC7A5EPHX1
SCHEMBL2132468 0.85 CA1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 CYSLTR2 632/4885CYSLTR1 384/4885RNPEP 1177/4885

“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.