SCHEMBL2136608

SCHEMBL2136608

CC(SCCCC(F)(F)F)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.38
CYSLTR2 Q9NS75 1/20 0.34
CYSLTR1 Q9Y271 1/20 0.34
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALOX5 P09917 1/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
CYP2C19 P33261 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
SCHEMBL2135625 0.94 EPHX1 (0.41) EPHX1CYSLTR2CYSLTR1ALDH1A1HSD17B10
SCHEMBL2138737 0.93 EPHX1 (0.43) EPHX1CYSLTR2CYSLTR1ALDH1A1HSD17B10
SCHEMBL2131384 0.93 EPHX1 (0.43) EPHX1CYSLTR2CYSLTR1ALDH1A1HSD17B10
SCHEMBL1129818 0.88 ALDH1A1 (0.33) EPHX1CYSLTR2CYSLTR1ALDH1A1HSD17B10
SCHEMBL2139066 0.87 EPHX1 (0.37) EPHX1ALDH1A1HSD17B10
SCHEMBL2136008 0.85 EPHX1 (0.36) EPHX1ALDH1A1HSD17B10
SCHEMBL4318348 0.85 EPHX1 (0.36) EPHX1ALDH1A1HSD17B10
SCHEMBL2133196 0.84 EPHX1 (0.39) EPHX1
SCHEMBL2132219 0.84 EPHX1 (0.35) EPHX1ALDH1A1HSD17B10KDM4ELMNA
SCHEMBL2132758 0.82 EPHX1 (0.41) EPHX1

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 EPHX1 2018/4885CYSLTR2 632/4885CYSLTR1 384/4885

“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.