SCHEMBL5370637

SCHEMBL5370637

C/C(C=O)=C\C1(C(=O)OC2CCCCC2)CC1(C)C

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.34
CYP2C19 P33261 1/20 0.33
NAAA Q02083 1/20 0.32
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL5370641 1.00 EPHX1 (0.34) EPHX1CYP2C19NAAAHTTSMN1; SMN2
SCHEMBL5377605 0.82 EPHX1 (0.34) EPHX1CYP2C19NAAAHTTSMN1; SMN2
SCHEMBL5377600 0.82 EPHX1 (0.34) EPHX1CYP2C19NAAAHTTSMN1; SMN2
SCHEMBL5372637 0.81 EPHX1 (0.36) EPHX1CYP2C19NAAAHTTSMN1; SMN2
SCHEMBL5372644 0.81 EPHX1 (0.36) EPHX1CYP2C19NAAAHTTSMN1; SMN2
SCHEMBL5370833 0.79 MEN1 (0.31)
SCHEMBL5370829 0.79 MEN1 (0.31)
SCHEMBL5373356 0.72 TSHR (0.33)
SCHEMBL5370736 0.72
SCHEMBL5367074 0.72 POLB (0.38)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276622-B2 Method for producing oxygen-containing compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-02 US disclosed
US-20060173221-A1 Method for producing oxygen-containing compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-08-03 US disclosed
EP-1609777-A1 METHOD FOR PRODUCING OXYGEN-CONTAINING COMPOUND Sumitomo Chemical Company, Limited (JP) 2005-12-28 EP 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-20060173221-A1 Method for producing oxygen-containing compound GPX4, DUOX2, SCO2 EPHX1 478/4885CYP2C19 563/4885NAAA 2120/4885

“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.