SCHEMBL13435173

SCHEMBL13435173

O=C1C(Cc2cccc(C(F)(F)F)c2F)CCN1C1C2CC3CC(C2)CC1C3

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.59
P2RX7 Q99572 9/20 0.38
AKR1B1 P15121 1/20 0.35
CYP27A1 Q02318 1/20 0.34
CYP24A1 Q07973 1/20 0.34
NOTUM Q6P988 1/20 0.34
KCNH2 Q12809 1/20 0.33
GRM2 Q14416 1/20 0.33

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
SCHEMBL13435165 0.84 HSD11B1 (0.61) HSD11B1CYP24A1
SCHEMBL3426077 0.78 HSD11B1 (0.53) HSD11B1
SCHEMBL13435182 0.76 HSD11B1 (0.67) HSD11B1
SCHEMBL13435186 0.75 HSD11B1 (0.76) HSD11B1
SCHEMBL13435191 0.74 HSD11B1 (1.00) HSD11B1
SCHEMBL13435177 0.74 HSD11B1 (0.64) HSD11B1
SCHEMBL13435179 0.73 HSD11B1 (0.59) HSD11B1
SCHEMBL13435168 0.73 HSD11B1 (0.68) HSD11B1
SCHEMBL13435187 0.73 HSD11B1 (0.68) HSD11B1
SCHEMBL3422925 0.72 HSD11B1 (0.66) HSD11B1

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
US-7687644-B2 Adamantyl pyrrolidin-2-one derivatives as 11-beta hydroxysteroid dehydrogenase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2010-03-30 US disclosed
US-7687644-B2 Adamantyl pyrrolidin-2-one derivatives as 11-beta hydroxysteroid dehydrogenase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2010-03-30 US disclosed
US-20070287743-A1 Adamantyl Pyrrolidin-2-One Derivatives as 11-Beta Hydroxtsteroid Dehydrogenase Inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2007-12-13 US disclosed
US-20070287743-A1 Adamantyl Pyrrolidin-2-One Derivatives as 11-Beta Hydroxtsteroid Dehydrogenase Inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2007-12-13 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-20070287743-A1 Adamantyl Pyrrolidin-2-One Derivatives as 11-Beta Hydroxtsteroid Dehydrogenase Inhibitors HSD11B1, HSD11B2, HSDL2 HSD11B1 1/4885P2RX7 4237/4885AKR1B1 64/4885

“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.