SCHEMBL1129818

SCHEMBL1129818

CC(SCCC(F)(F)F)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
EPHX1 P07099 1/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
CYSLTR2 Q9NS75 1/20 0.30
CYSLTR1 Q9Y271 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
SCHEMBL2136608 0.88 EPHX1 (0.38) ALDH1A1HSD17B10EPHX1LMNAKDM4E
SCHEMBL2135625 0.86 EPHX1 (0.41) ALDH1A1HSD17B10EPHX1CYSLTR2CYSLTR1
SCHEMBL2131384 0.85 EPHX1 (0.43) ALDH1A1HSD17B10EPHX1CYSLTR2CYSLTR1
SCHEMBL2138737 0.85 EPHX1 (0.43) ALDH1A1HSD17B10EPHX1CYSLTR2CYSLTR1
SCHEMBL2134866 0.84 ALDH1A1 (0.32) ALDH1A1HSD17B10EPHX1LMNAKDM4E
SCHEMBL28227607 0.82 EPHX1 (0.32) EPHX1
SCHEMBL17687707 0.82 EPHX1 (0.52) EPHX1
SCHEMBL2136825 0.80 EPHX1 (0.31) EPHX1
SCHEMBL2135203 0.79 SMN1; SMN2 (0.36) ALDH1A1EPHX1KDM4E
SCHEMBL2139066 0.79 EPHX1 (0.37) ALDH1A1HSD17B10EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105636444-B Process for preparing pesticidal compounds 美国陶氏益农公司 2018-04-27 CN disclosed
EP-2775843-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO Dow AgroSciences LLC (US) 2014-09-17 EP disclosed
WO-2013062981-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-05-02 WO disclosed
US-20120101294-A1 PROCESS FOR PRODUCING (FLUOROALKYLTHIO) ACETIC ACID ESTER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-26 US disclosed
EP-2160378-B1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD SUMITOMO CHEMICAL CO (JP) 2011-02-16 EP 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 ALDH1A1 41/4885HSD17B10 232/4885EPHX1 2018/4885

“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.