SCHEMBL2135389

SCHEMBL2135389

CCOC(=O)C(C)SCCCC(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.38
NPSR1 Q6W5P4 2/20 0.36
ALDH1A1 P00352 4/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 2/20 0.33
METAP2 P50579 2/20 0.31
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP4F2 P78329 2/20 0.30
CYP4A11 Q02928 2/20 0.30
POLB P06746 2/20 0.30
THRB P10828 1/20 0.30
PKM P14618 1/20 0.30
TP53 P04637 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
SCHEMBL2134185 0.95 EPHX1 (0.40) EPHX1NPSR1ALDH1A1MAPTLMNA
SCHEMBL2135372 0.94 EPHX1 (0.42) EPHX1NPSR1ALDH1A1MAPTHPGD
SCHEMBL2133716 0.94 EPHX1 (0.42) EPHX1NPSR1ALDH1A1MAPTHPGD
SCHEMBL2133117 0.90 NPSR1 (0.38) EPHX1NPSR1ALDH1A1MAPTLMNA
SCHEMBL2133812 0.89 EPHX1 (0.37) EPHX1NPSR1ALDH1A1MAPTLMNA
SCHEMBL2137657 0.87 EPHX1 (0.36) EPHX1NPSR1ALDH1A1MAPTLMNA
SCHEMBL2134723 0.87 EPHX1 (0.36) EPHX1NPSR1ALDH1A1MAPTLMNA
SCHEMBL2135491 0.87 EPHX1 (0.39) EPHX1
SCHEMBL2137655 0.86 EPHX1 (0.41) EPHX1NPSR1ALDH1A1MAPTLMNA
SCHEMBL2138685 0.86 EPHX1 (0.38) EPHX1NPSR1ALDH1A1MAPTLMNA

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 2018/4885NPSR1 3120/4885ALDH1A1 41/4885

“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.