SCHEMBL4516157

SCHEMBL4516157

Cc1cc(N2CCN(C(=O)OCC(C)C)CC2)ccc1C(=O)N1CC[C@@]2(C1)OC(=O)c1ccccc12

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.43
HSD11B1 P28845 9/20 0.42
CYP2D6 P10635 1/20 0.40
NPY5R Q15761 1/20 0.39
AVPR1A P37288 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
CHRM5 P08912 1/20 0.39
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL4517167 0.94 PDK2 (0.43) PDK2HSD11B1CYP2D6NPY5RAVPR1A
SCHEMBL4517168 0.94 PDK2 (0.43) PDK2HSD11B1CYP2D6NPY5RAVPR1A
SCHEMBL4525234 0.93 PDK2 (0.51) PDK2HSD11B1CYP2D6NPY5RAVPR1A
SCHEMBL4508489 0.91 HSD11B1 (0.43) PDK2HSD11B1CYP2D6NPY5RAVPR1A
SCHEMBL4526271 0.90 PDK2 (0.46) PDK2HSD11B1CYP2D6NPY5RAVPR1A
SCHEMBL4525727 0.90 PDK2 (0.50) PDK2HSD11B1CYP2D6NPY5RAVPR1A
SCHEMBL4512269 0.88 PDK2 (0.48) PDK2HSD11B1CYP2D6NPY5RAVPR1A
SCHEMBL4503700 0.88 PDK2 (0.43) PDK2HSD11B1CYP2D6NPY5RAVPR1A
SCHEMBL4527578 0.87 PDK2 (0.48) PDK2HSD11B1CYP2D6NPY5RAVPR1A
SCHEMBL13606671 0.86 PDK2 (0.51) PDK2HSD11B1CYP2D6AVPR1A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090298808-A1 INHIBITORS OF 11-BETA HYDROXYL STEROID DEHYDROGENASE TYPE I AND METHODS OF USING THE SAME INCYTE CORPORATION, A DELAWARE CORPORATION 2009-12-03 US claimed
US-20060122210-A1 Inhibitors of 11-beta hydroxyl steroid dehydrogenase type I and methods of using the same INCYTE CORPORATION 2006-06-08 US claimed
US-20090298808-A1 INHIBITORS OF 11-BETA HYDROXYL STEROID DEHYDROGENASE TYPE I AND METHODS OF USING THE SAME INCYTE CORPORATION, A DELAWARE CORPORATION 2009-12-03 US disclosed
US-20090298808-A1 INHIBITORS OF 11-BETA HYDROXYL STEROID DEHYDROGENASE TYPE I AND METHODS OF USING THE SAME INCYTE CORPORATION, A DELAWARE CORPORATION 2009-12-03 US disclosed
US-20090298808-A1 INHIBITORS OF 11-BETA HYDROXYL STEROID DEHYDROGENASE TYPE I AND METHODS OF USING THE SAME INCYTE CORPORATION, A DELAWARE CORPORATION 2009-12-03 US disclosed
US-20060122210-A1 Inhibitors of 11-beta hydroxyl steroid dehydrogenase type I and methods of using the same INCYTE CORPORATION 2006-06-08 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 (2 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-20060122210-A1 Inhibitors of 11-beta hydroxyl steroid dehydrogenase type I and methods of using the same HSD11B1, HSD11B2, HSD17B1 PDK2 609/4885HSD11B1 1/4885CYP2D6 253/4885
US-20090298808-A1 INHIBITORS OF 11-BETA HYDROXYL STEROID DEHYDROGENASE TYPE I AND METHODS OF USING THE SAME HSD11B1, HSD11B2, HSD17B1 PDK2 609/4885HSD11B1 1/4885CYP2D6 253/4885

“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.