SCHEMBL2136369

SCHEMBL2136369

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

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.41
CA2 P00918 1/20 0.36
MAPK1 P28482 1/20 0.36
ALOX5 P09917 9/20 0.34
PPARG P37231 9/20 0.34
PTGES O14684 6/20 0.34
PPARA Q07869 5/20 0.34
MAPT P10636 1/20 0.34
EPHX1 P07099 2/20 0.34
CES1 P23141 1/20 0.33
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
GPR84 Q9NQS5 2/20 0.32

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
SCHEMBL2138379 0.92 CHRM1 (0.33) HSD17B10CA2MAPK1PPARAMAPT
SCHEMBL2135318 0.91 HSD17B10 (0.41) HSD17B10CA2MAPK1ALOX5PPARG
SCHEMBL2133034 0.88 HTT (0.31) CA2MAPK1EPHX1CES1
SCHEMBL2134330 0.88 HSD17B10 (0.43) HSD17B10CA2MAPK1ALOX5PPARG
SCHEMBL2137757 0.87 HSD17B10 (0.40) HSD17B10CA2MAPK1ALOX5PPARG
SCHEMBL2138708 0.86 HSD17B10 (0.42) HSD17B10CA2MAPK1ALOX5PPARG
SCHEMBL2132622 0.85 EPHX1 (0.32) EPHX1
SCHEMBL2133533 0.85 HSD17B10 (0.41) HSD17B10CA2MAPK1ALOX5PPARG
SCHEMBL2132709 0.84 CA1 (0.34) CA2ALOX5EPHX1CES1
SCHEMBL2136297 0.84 CA1 (0.44) HSD17B10CA2EPHX1CES1

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 HSD17B10 232/4885CA2 737/4885MAPK1 1590/4885

“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.