SCHEMBL10069424

SCHEMBL10069424

CCC(C)(C(=O)OC(C)(C)C)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.43
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL12336624 0.83 DGAT1 (0.38) DGAT1CA12CA1CA7CA14
SCHEMBL13087838 0.82 DGAT1 (0.40) DGAT1CA12CA1CA7CA14
SCHEMBL106943 0.82 DGAT1 (0.40) DGAT1CA12CA1CA7CA14
SCHEMBL9966137 0.79 DGAT1 (0.41) DGAT1CA12CA1CA7CA14
SCHEMBL17617164 0.76 CYP4F2 (0.42)
SCHEMBL17617200 0.76 CYP4F2 (0.42)
SCHEMBL14041111 0.76 DGAT1 (0.39) DGAT1CA1CA7
SCHEMBL16938765 0.76
SCHEMBL15082441 0.75 DGAT1 (0.46) DGAT1CA12CA1CA7CA14
SCHEMBL47394 0.75 DGAT1 (0.46) DGAT1CA12CA1CA7CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160083341-A1 METHOD FOR PRODUCING a-SUBSTITUTED CYSTEINE OR SALT THEREOF OR SYNTHETIC INTERMEDIATE OF a-SUBSTITUTED CYSTEINE API CORPORATION (JP) 2016-03-24 US disclosed
EP-2423748-A1 Lithographic printing plate precursor and plate making method thereof Fujifilm Corporation (JP) 2012-02-29 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-20160083341-A1 METHOD FOR PRODUCING a-SUBSTITUTED CYSTEINE OR SALT THEREOF OR SYNTHETIC INTERMEDIATE OF a-SUBSTITUTED CYSTEINE MGMT, GSTA1, CBS DGAT1 917/4885CA12 454/4885CA1 683/4885

“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.