SCHEMBL2138358

SCHEMBL2138358

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

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.39
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.35
FAAH O00519 5/20 0.35
CA1 P00915 2/20 0.33
ZDHHC7 Q9NXF8 1/20 0.33
ABCB1 P08183 1/20 0.32
ALOX15 P16050 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 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
SCHEMBL2131949 0.97 LMNA (0.37) EPHX1LMNAMAPTFAAHCA1
SCHEMBL2135767 0.97 EPHX1 (0.36) EPHX1LMNAMAPTFAAHCA1
SCHEMBL2134395 0.93 EPHX1 (0.33) EPHX1LMNAFAAH
SCHEMBL2137621 0.93 CA2 (0.35) EPHX1LMNAFAAHCA1ALOX15
SCHEMBL2137187 0.89 FAAH (0.38) EPHX1LMNAMAPTFAAHCA1
SCHEMBL2134542 0.89 EPHX1 (0.41) EPHX1LMNAMAPTFAAHCA1
SCHEMBL2138460 0.89 LMNA (0.33) EPHX1LMNAALOX15
SCHEMBL2137427 0.89 EPHX1 (0.41) EPHX1LMNAMAPTFAAHCA1
SCHEMBL2132783 0.87 EPHX1 (0.43) EPHX1LMNAMAPTFAAHZDHHC7
SCHEMBL2134141 0.87 ZDHHC7 (0.43) EPHX1LMNAMAPTCA1ZDHHC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2664613-A1 Process for producing amide compounds Sumitomo Chemical Company, Limited (JP) 2013-11-20 EP disclosed
EP-2662355-A1 Process for producing a (fluoroalkylthio) acetonitrile Sumitomo Chemical Company, Limited (JP) 2013-11-13 EP disclosed
EP-2465846-A1 PROCESS FOR PREPARATION OF (FLUOROALKYLTHIO)ACETIC ACID ESTERS Sumitomo Chemical Company, Limited (JP) 2012-06-20 EP disclosed
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 2018/4885LMNA 4769/4885MAPT 4195/4885

“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.