SCHEMBL4516802

SCHEMBL4516802

CCOC(=O)N1CCN(c2ccc(C(=O)N3CC[C@@]4(C3)OC(=O)c3ccccc34)c(Cl)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.51
MAPT P10636 2/20 0.51
HTT P42858 1/20 0.51
PDK2 Q15119 2/20 0.49
AVPR1A P37288 1/20 0.46
HSD11B1 P28845 6/20 0.46
CYP2D6 P10635 1/20 0.46
NPY5R Q15761 3/20 0.42
CHRM5 P08912 1/20 0.41
LMNA P02545 3/20 0.41
KMT2A Q03164 3/20 0.41
GAA P10253 2/20 0.41
MEN1 O00255 1/20 0.40
GFER P55789 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL4507956 0.94 MAPT (0.44) MAPK1MAPTHTTPDK2AVPR1A
SCHEMBL4508489 0.92 HSD11B1 (0.43) MAPK1MAPTHTTPDK2AVPR1A
SCHEMBL4507285 0.92 MAPT (0.49) MAPK1MAPTPDK2AVPR1AHSD11B1
SCHEMBL4525234 0.92 PDK2 (0.51) MAPK1MAPTHTTPDK2AVPR1A
SCHEMBL4517416 0.90 PDK2 (0.51) MAPK1MAPTHTTPDK2AVPR1A
SCHEMBL4517418 0.90 PDK2 (0.51) MAPK1MAPTHTTPDK2AVPR1A
SCHEMBL4519969 0.90 HSD11B1 (0.47) PDK2AVPR1AHSD11B1CYP2D6NPY5R
SCHEMBL13606665 0.89 PDK2 (0.50) MAPTPDK2AVPR1AHSD11B1CYP2D6
SCHEMBL4518852 0.89 HSD11B1 (0.49) PDK2AVPR1AHSD11B1CYP2D6NPY5R
SCHEMBL4516990 0.88 AVPR1A (0.46) MAPTPDK2AVPR1AHSD11B1CYP2D6

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 MAPK1 1212/4885MAPT 3956/4885HTT 3570/4885
US-20090298808-A1 INHIBITORS OF 11-BETA HYDROXYL STEROID DEHYDROGENASE TYPE I AND METHODS OF USING THE SAME HSD11B1, HSD11B2, HSD17B1 MAPK1 1212/4885MAPT 3956/4885HTT 3570/4885

“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.