SCHEMBL2135111

SCHEMBL2135111

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

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.40
FFAR1 O14842 1/20 0.31
CPT2 P23786 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ACACB O00763 1/20 0.30
ACACA Q13085 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL2134102 0.98 EPHX1 (0.42) EPHX1FFAR1CPT2TDP1ACACB
SCHEMBL2139066 0.95 EPHX1 (0.37) EPHX1ALDH1A1HSD17B10
SCHEMBL2135625 0.87 EPHX1 (0.41) EPHX1ALDH1A1HSD17B10
SCHEMBL2138737 0.86 EPHX1 (0.43) EPHX1FFAR1CPT2TDP1ACACB
SCHEMBL2131384 0.86 EPHX1 (0.43) EPHX1FFAR1CPT2TDP1ACACB
SCHEMBL2135833 0.84 EPHX1 (0.39) EPHX1
SCHEMBL2133406 0.83 EPHX1 (0.31) EPHX1
SCHEMBL2136683 0.83 EPHX1 (0.41) EPHX1
SCHEMBL2134674 0.83 EPHX1 (0.41) EPHX1
SCHEMBL2136608 0.81 EPHX1 (0.38) EPHX1ALDH1A1HSD17B10

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 2018/4885FFAR1 18/4885CPT2 1264/4885

“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.