SCHEMBL9610778

SCHEMBL9610778

CC1(C)OCC(COC(=O)COC(=O)C(C)(F)F)O1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.43
DGAT1 O75907 1/20 0.37
ALDH1A1 P00352 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HTR7 P34969 1/20 0.34
APP P05067 1/20 0.32
TMEM97 Q5BJF2 2/20 0.32
SIGMAR1 Q99720 2/20 0.32

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
SCHEMBL9610772 0.90 CA2 (0.48) CA2DGAT1ALDH1A1NPSR1HTR7
SCHEMBL9610791 0.86 PABPC1 (0.36) ALDH1A1
SCHEMBL9612226 0.85 CA2 (0.45) CA2DGAT1HTR7APP
SCHEMBL9610773 0.85 PABPC1 (0.38) ALDH1A1TMEM97SIGMAR1
SCHEMBL12199638 0.83 CA2 (0.49) CA2DGAT1ALDH1A1NPSR1HTR7
SCHEMBL12018883 0.82 ALDH1A1 (0.44) ALDH1A1
SCHEMBL9610777 0.81
SCHEMBL12199636 0.81 CA2 (0.47) CA2DGAT1ALDH1A1NPSR1HTR7
SCHEMBL25819885 0.79 CA2 (0.48) CA2DGAT1ALDH1A1NPSR1HTR7
SCHEMBL11922847 0.79 CA2 (0.50) CA2DGAT1ALDH1A1NPSR1HTR7

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-8420294-B2 Salt and photoresist composition comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-04-16 US disclosed
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 122/4885DGAT1 316/4885ALDH1A1 3397/4885

“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.