SCHEMBL6235692

SCHEMBL6235692

O=C(c1ccc(OC(F)(F)F)cc1)C1CCN(C(=O)C2CCCCC2)CC1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.67
MGLL Q99685 5/20 0.65
EPHX2 P34913 5/20 0.56
KDM2B Q8NHM5 1/20 0.56
POLB P06746 2/20 0.49
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KMT2A Q03164 1/20 0.46

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
SCHEMBL27957268 0.85 HSD11B1 (0.61) HSD11B1MGLLEPHX2KDM2BPOLB
SCHEMBL14637673 0.84 HSD11B1 (0.73) HSD11B1MGLLEPHX2KDM2BPOLB
SCHEMBL6140623 0.81 HSD11B1 (0.66) HSD11B1MGLLEPHX2KDM2BPOLB
SCHEMBL12576441 0.80 HSD11B1 (1.00) HSD11B1MGLLPOLBALDH1A1LMNA
SCHEMBL4236625 0.79 HSD11B1 (0.65) HSD11B1MGLLEPHX2KDM2BPOLB
SCHEMBL30534113 0.76 TP53 (0.64) ALDH1A1SMN1; SMN2KMT2A
SCHEMBL13873393 0.75 CYP2C9 (0.76) HSD11B1MGLLEPHX2POLBKMT2A
SCHEMBL9965446 0.75 GAA (0.54) EPHX2ALDH1A1SMN1; SMN2KMT2A
SCHEMBL27968916 0.75 HSD11B1 (0.60) HSD11B1MGLLEPHX2KDM2BPOLB
SCHEMBL5472042 0.75 HSD11B1 (0.62) HSD11B1MGLLPOLBALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1723199-A 1,4-disubstituted piperidine derivatives and their use as 11-beta hsd1 inhibitors ASTRAZENECA AB (SE) 2006-01-18 CN disclosed
US-20050256159-A1 1,4-disubstituted piperidine derivatives and their use as 11,betahsd1 inhibitors ASTRAZENECA AB (SE) 2005-11-17 US disclosed
EP-1556349-A1 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS 11-BETAHSD1 INHIBITORS Astrazeneca AB (SE) 2005-07-27 EP disclosed
WO-2004033427-A1 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES AND THEIR USE AS 11-BETAHSD1 INHIBITORS ASTRAZENECA AB (SE) 2004-04-22 WO 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-20050256159-A1 1,4-disubstituted piperidine derivatives and their use as 11,betahsd1 inhibitors HSD11B1, HSD3B1, P4HA1 HSD11B1 1/4885MGLL 2824/4885EPHX2 796/4885

“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.