SCHEMBL17586289

SCHEMBL17586289

CC(C)(O)C12CC(NC(=O)C(F)(F)F)(C1)C2

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 2/20 0.35
CA2 P00918 1/20 0.33
NSD2 O96028 2/20 0.30

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
SCHEMBL17586282 0.86 CA2 (0.34) CA2NSD2
SCHEMBL17586261 0.78 HPGDS (0.37) HPGDS
SCHEMBL20995175 0.78 HPGDS (0.37) HPGDS
SCHEMBL16039108 0.75 CA2 (0.39) CA2
SCHEMBL21217384 0.72
SCHEMBL17586290 0.72 MEN1 (0.41) HPGDSCA2
SCHEMBL17586263 0.69 DPP8 (0.32)
SCHEMBL17586258 0.68
SCHEMBL17586281 0.67 EPHX2 (0.46) CA2
Trifluoroacetic Acid SCHEMBL29709152 0.67 ALDH1A1 (0.33)

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-20160075654-A1 BICYCLIC COMPOUNDS RECURIUM IP HOLDINGS, LLC 2016-03-17 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-20160075654-A1 BICYCLIC COMPOUNDS OPRK1, OPRM1, OPRL1 HPGDS 309/4885CA2 1040/4885NSD2 2947/4885

“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.