SCHEMBL6209178

SCHEMBL6209178

O=C(c1ccccc1)C1CCN(C(=O)C(F)(F)F)CC1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.61
KMT2A Q03164 3/20 0.59
CPB1 P15086 1/20 0.58
MGLL Q99685 5/20 0.57
MEN1 O00255 2/20 0.57
ALDH1A1 P00352 1/20 0.55
RIPK1 Q13546 1/20 0.53
HTR2A P28223 1/20 0.51
KDM1A O60341 1/20 0.51

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
SCHEMBL4244603 0.85 HSD11B1 (0.64) HSD11B1KMT2AMGLLMEN1
SCHEMBL14269013 0.84 KMT2A (0.64) HSD11B1KMT2ACPB1MGLLMEN1
SCHEMBL2556107 0.82 CPB1 (0.67) HSD11B1KMT2ACPB1MGLLMEN1
SCHEMBL5214742 0.80 HSD11B1 (0.67) HSD11B1KMT2AMGLLALDH1A1HTR2A
SCHEMBL1720183 0.80 MGLL (0.82) HSD11B1KMT2ACPB1MGLLMEN1
SCHEMBL5207580 0.79 HSD11B1 (0.65) HSD11B1KMT2AMGLLMEN1ALDH1A1
SCHEMBL7330630 0.79 CPB1 (0.63) HSD11B1KMT2ACPB1MGLLMEN1
SCHEMBL1720793 0.79 HSD11B1 (0.81) HSD11B1KMT2ACPB1MGLLMEN1
SCHEMBL571141 0.78 KDM1A (0.60) HSD11B1ALDH1A1RIPK1KDM1A
SCHEMBL2202147 0.77 ALDH1A1 (0.60) HSD11B1KMT2ACPB1MGLLMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1/4885KMT2A 1395/4885CPB1 3779/4885

“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.