SCHEMBL2134952

SCHEMBL2134952

CCCCC(SCCCCCC(C)F)C(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.37
CTSK P43235 7/20 0.35
MAPT P10636 1/20 0.33
FAAH O00519 1/20 0.33
CA2 P00918 2/20 0.33
CA1 P00915 1/20 0.33
SMPD1 P17405 3/20 0.32
CTSS P25774 1/20 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
SCHEMBL2135909 0.99 CTSK (0.36) EPHX1CTSKMAPTFAAHCA2
SCHEMBL2136530 0.97 EPHX1 (0.40) EPHX1CTSKMAPTFAAHSMPD1
SCHEMBL2134086 0.96 EPHX1 (0.38) EPHX1CTSKMAPTFAAHCA1
SCHEMBL2132723 0.95 EPHX1 (0.36) EPHX1CTSKMAPTFAAHSMPD1
SCHEMBL2136487 0.95 CTSK (0.36) EPHX1CTSKCA2CA1CTSS
SCHEMBL2138092 0.93 EPHX1 (0.35) EPHX1CTSKMAPTFAAHCA1
SCHEMBL2135213 0.93 EPHX1 (0.33) EPHX1CTSKFAAH
SCHEMBL2133359 0.91 EPHX1 (0.35) EPHX1CTSKMAPTFAAHCA2
SCHEMBL2136339 0.91 EPHX1 (0.35) EPHX1CTSKMAPTFAAHCA2
SCHEMBL2138073 0.89 CA2 (0.34) EPHX1CTSKMAPTCA2CA1

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 2018/4885CTSK 2835/4885MAPT 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.