SCHEMBL13435170

SCHEMBL13435170

O=C1C(Cc2cccc(Br)c2)CCN1C1C2CC3CC(C2)CC1C3

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.73
MBTD1 Q05BQ5 1/20 0.36
L3MBTL3 Q96JM7 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MMP2 P08253 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
RORC P51449 1/20 0.34
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
ROCK2 O75116 1/20 0.33
PARP1 P09874 1/20 0.33
PARP2 Q9UGN5 1/20 0.33
DRD4 P21917 1/20 0.33
NR3C1 P04150 1/20 0.32

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
SCHEMBL13435191 0.85 HSD11B1 (1.00) HSD11B1ALDH1A1ROCK2
SCHEMBL3421958 0.84 HSD11B1 (0.70) HSD11B1SMN1; SMN2SIGMAR1ALDH1A1ROCK2
SCHEMBL13435172 0.83 HSD11B1 (0.69) HSD11B1ALDH1A1ROCK2DRD4NR3C1
SCHEMBL13435168 0.80 HSD11B1 (0.68) HSD11B1ROCK2
SCHEMBL2999509 0.79 HSD11B1 (0.57) HSD11B1ROCK2
SCHEMBL3427426 0.79 HSD11B1 (0.78) HSD11B1SMN1; SMN2ALDH1A1POLB
SCHEMBL13435181 0.78 HSD11B1 (0.68) HSD11B1ALDH1A1POLB
SCHEMBL13435184 0.78 HSD11B1 (0.76) HSD11B1SMN1; SMN2ALDH1A1
SCHEMBL13435186 0.78 HSD11B1 (0.76) HSD11B1POLBROCK2
SCHEMBL3428183 0.77 HSD11B1 (0.61) HSD11B1SMN1; SMN2ALDH1A1ROCK2

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 1/4885MBTD1 1762/4885L3MBTL3 3633/4885

“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.