SCHEMBL2140975

SCHEMBL2140975

CCCCCC(SCCCC(F)(F)C(F)F)C(=O)OC(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
SMPD1 P17405 3/20 0.31
CTSK P43235 1/20 0.31
ZDHHC7 Q9NXF8 1/20 0.30
AAK1 Q2M2I8 1/20 0.30
EPHX1 P07099 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
SCHEMBL2139642 0.96 CA1 (0.35) CA1CA2CTSKAAK1EPHX1
SCHEMBL2135102 0.92 AAK1 (0.31) AAK1
SCHEMBL2137172 0.90 MAPT (0.31) MAPTCA1CA2
SCHEMBL2134690 0.89 LMNA (0.35) MAPTCA1ZDHHC7EPHX1
SCHEMBL2138643 0.88 AAK1 (0.36) MAPTCA1CA2SMPD1CTSK
SCHEMBL2135985 0.88 CA1 (0.33) MAPTCA1CA2SMPD1CTSK
SCHEMBL2136553 0.87 MAPT (0.33) MAPTZDHHC7EPHX1
SCHEMBL2134448 0.87 ZDHHC7 (0.40) MAPTCA1CA2ZDHHC7EPHX1
SCHEMBL2134505 0.86 CA1 (0.33) CA1CA2CTSK
SCHEMBL2135116 0.86 CA1 (0.35) CA1CA2SMPD1CTSKZDHHC7

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 MAPT 4195/4885CA1 617/4885CA2 737/4885

“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.