SCHEMBL9612231

SCHEMBL9612231

CC1(C)OCC(COC(=O)C23CC4CC(CC(OC(=O)C(F)(F)S(=O)(=O)O)(C4)C2)C3)O1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL9610781 0.89 NPSR1 (0.34) CA2NPSR1
SCHEMBL9612210 0.88 L3MBTL1 (0.30)
SCHEMBL9612208 0.87 CA2 (0.35) CA2NPSR1
SCHEMBL9612245 0.82 CA2 (0.36) CA2
SCHEMBL16810448 0.81
SCHEMBL17550525 0.80 ALDH1A1 (0.37)
SCHEMBL17550524 0.79
SCHEMBL9612197 0.79 CA2 (0.50) CA2NPSR1
SCHEMBL12947967 0.79 NPSR1 (0.38) NPSR1
SCHEMBL9610788 0.79 NPSR1 (0.32) NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120135351-A1 SALT AND PHOTORESIST COMPOSITION COMPRISING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-31 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-20120135351-A1 SALT AND PHOTORESIST COMPOSITION COMPRISING THE SAME C1R, AFF1, C1S CA2 122/4885NPSR1 360/4885

“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.