SCHEMBL2137133

SCHEMBL2137133

COC(=O)C(CC(C)C)SCCCC(C)F

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.34
MME P08473 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
BIRC2 Q13490 2/20 0.32
MIF P14174 1/20 0.32
TAS1R3 Q7RTX0 2/20 0.31
TAS1R1 Q7RTX1 2/20 0.31
ZDHHC7 Q9NXF8 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
SCHEMBL2135472 0.95 BIRC2 (0.33) FOLH1MMECA1CA2BIRC2
SCHEMBL2138511 0.94 ZDHHC7 (0.35) FOLH1MMECA1CA2BIRC2
SCHEMBL2134502 0.87 CA1 (0.39) CA1CA2BIRC2ZDHHC7
SCHEMBL2137589 0.87 FOLH1 (0.31) FOLH1
SCHEMBL2132611 0.86 CA1 (0.36) FOLH1MMECA1CA2BIRC2
SCHEMBL2135843 0.86 TSHR (0.33) FOLH1
SCHEMBL2135432 0.86 METAP2 (0.33) FOLH1
SCHEMBL2135703 0.86 BIRC2 (0.33) FOLH1MMECA1CA2BIRC2
SCHEMBL2135453 0.85 CA1 (0.35) FOLH1CA1CA2BIRC2TAS1R3
SCHEMBL2140080 0.84 ZDHHC7 (0.35) FOLH1MMECA1CA2BIRC2

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 FOLH1 1822/4885MME 1979/4885CA1 617/4885

“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.