SCHEMBL13712534

SCHEMBL13712534

CC(C)(C)OC(=O)N1CC[C@H](N(C(=O)c2ccccc2C(F)(F)F)C2CC3CCC2C3)C1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.46
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
HSD11B1 P28845 2/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
GPR119 Q8TDV5 12/20 0.41

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
SCHEMBL13712525 0.88 USP30 (0.47) USP30JAK2JAK1HSD11B1MEN1
SCHEMBL5887844 0.84 SLC6A2 (0.52) USP30MEN1KMT2AGPR119
SCHEMBL5232636 0.83 USP30 (0.51) USP30MEN1KMT2AGPR119
SCHEMBL671252 0.81 USP30 (0.66) USP30JAK2JAK1HSD11B1MEN1
SCHEMBL10074479 0.81 USP30 (0.66) USP30JAK2JAK1HSD11B1MEN1
SCHEMBL13712521 0.79 MEN1 (0.41) USP30JAK2JAK1HSD11B1MEN1
SCHEMBL4513146 0.73 RAB9A (0.41) HSD11B1
SCHEMBL13712526 0.72 JAK2 (0.48) USP30JAK2JAK1MEN1KMT2A
SCHEMBL5229717 0.71 USP30 (0.53) USP30MEN1KMT2AGPR119
SCHEMBL23585615 0.71 SCD (0.47) USP30JAK2JAK1MEN1KMT2A

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-20090239929-A1 N-Pyrrolidin-3-YL-Amide Derivatives As Serotonin and Noradrenalin Re-Uptake Inhibitors PFIZER INC. 2009-09-24 US disclosed
US-20090239929-A1 N-Pyrrolidin-3-YL-Amide Derivatives As Serotonin and Noradrenalin Re-Uptake Inhibitors PFIZER INC. 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-20090239929-A1 N-Pyrrolidin-3-YL-Amide Derivatives As Serotonin and Noradrenalin Re-Uptake Inhibitors TPH1, TPH2, HTR1A USP30 4242/4885JAK2 2564/4885JAK1 3274/4885

“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.