SCHEMBL2137751

SCHEMBL2137751

CCCCCC(SCCCF)C(=O)OCCCC

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
ALDH1A1 P00352 1/20 0.38
ATM Q13315 1/20 0.36
NAAA Q02083 1/20 0.35
EPHX1 P07099 2/20 0.35
ZDHHC7 Q9NXF8 1/20 0.35
TSHR P16473 3/20 0.34
HPGD P15428 1/20 0.34
SMPD1 P17405 2/20 0.33
ESR1 P03372 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL2138172 0.95 EPHX1 (0.37) MAPTALDH1A1ATMNAAAEPHX1
SCHEMBL2133845 0.95 ALDH1A1 (0.39) MAPTALDH1A1ATMNAAAEPHX1
SCHEMBL2134875 0.94 EPHX1 (0.40) MAPTALDH1A1ATMNAAAEPHX1
SCHEMBL2136088 0.94 EPHX1 (0.40) MAPTALDH1A1ATMNAAAEPHX1
SCHEMBL2136067 0.94 EPHX1 (0.40) MAPTALDH1A1ATMNAAAEPHX1
SCHEMBL2139841 0.94 MAPT (0.41) MAPTNAAAEPHX1ZDHHC7SMPD1
SCHEMBL2131573 0.92 ALDH1A1 (0.39) MAPTALDH1A1ATMNAAAEPHX1
SCHEMBL2135671 0.91 ALDH1A1 (0.38) MAPTALDH1A1ATMNAAAEPHX1
SCHEMBL2132458 0.90 EPHX1 (0.37) MAPTEPHX1ZDHHC7SMPD1
SCHEMBL2136065 0.90 EPHX1 (0.37) MAPTALDH1A1ATMNAAAEPHX1

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 4195/4885ALDH1A1 41/4885ATM 1990/4885

“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.