SCHEMBL2274474

SCHEMBL2274474

CC(C)(C)OC(=O)NC(C)(CF)C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.41
APLNR P35414 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA7 P43166 2/20 0.36
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
CA12 O43570 3/20 0.34
CA14 Q9ULX7 2/20 0.34
CTSK P43235 4/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
CYP2D6 P10635 1/20 0.33
AAK1 Q2M2I8 2/20 0.32
HTT P42858 1/20 0.31
CA9 Q16790 1/20 0.31
CTSS P25774 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
SCHEMBL28682014 0.92 DGAT1 (0.45) DGAT1APLNRTDP1CA1CA2
SCHEMBL28682013 0.92 DGAT1 (0.45) DGAT1APLNRTDP1CA1CA2
SCHEMBL13792087 0.87 APLNR (0.35) DGAT1APLNRTDP1CA1CA2
SCHEMBL28672286 0.85 MEN1 (0.39) APLNRTDP1CA1CA2CA7
SCHEMBL2279581 0.85 MEN1 (0.39) APLNRTDP1CA1CA2CA7
SCHEMBL7279185 0.85 MEN1 (0.39) APLNRTDP1CA1CA2CA7
SCHEMBL2280101 0.82 DGAT1 (0.42) DGAT1APLNRTDP1CA1CA2
SCHEMBL28277578 0.79 MEN1 (0.41) DGAT1APLNRTDP1CA1CA2
SCHEMBL13251395 0.79 DGAT1 (0.39) DGAT1APLNRTDP1CA1CA2
SCHEMBL28277557 0.79 DGAT1 (0.39) DGAT1APLNRTDP1CA1CA2

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
US-7989649-B2 Tumor imaging compounds EMORY UNIVERSITY (US) 2011-08-02 US disclosed
US-7989649-B2 Tumor imaging compounds EMORY UNIVERSITY (US) 2011-08-02 US disclosed
EP-1499584-B1 TUMOR IMAGING COMPOUNDS UNIV EMORY (US) 2010-08-18 EP disclosed
US-20090240041-A1 TUMOR IMAGING COMPOUNDS EMORY UNIVERSITY (US) 2009-09-24 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-20090240041-A1 TUMOR IMAGING COMPOUNDS AADAT, MKI67, SSTR1 DGAT1 4582/4885APLNR 306/4885TDP1 4506/4885

“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.