SCHEMBL14639593

SCHEMBL14639593

COC(=O)CC1C(=O)CC2CCC1N2

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.38
SLC6A4 P31645 3/20 0.34
SLC6A3 Q01959 3/20 0.34
SLC6A2 P23975 2/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL1010827 0.73 SLC6A3 (0.42) SLC6A4SLC6A3SLC6A2
SCHEMBL7244695 0.68
SCHEMBL10779350 0.68 BRD4 (0.39) BRD4SLC6A3GAA
SCHEMBL19736432 0.66 BRD4 (0.39) BRD4GAA
SCHEMBL14468370 0.66 BRD4 (0.39) BRD4GAA
SCHEMBL29030969 0.65 ATM (0.44) BRD4SLC6A4SLC6A3SLC6A2GAA
SCHEMBL10641800 0.65 SMN1; SMN2 (0.41) BRD4GAA
SCHEMBL2477633 0.65 AKR1C4 (0.51) BRD4GAA
SCHEMBL11514658 0.65 AKR1C4 (0.48) BRD4GAA
SCHEMBL2477632 0.65 AKR1C4 (0.51) BRD4GAA

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-20070009432-A1 Boat tropanes PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2007-01-11 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-20070009432-A1 Boat tropanes SLC6A3, SLC18A2, SLC6A4 BRD4 1768/4885SLC6A4 3/4885SLC6A3 1/4885

“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.