SCHEMBL4697258

SCHEMBL4697258

COc1ccc(-c2ccc3cc(CC4CCN(C5CCCCC5)C4=O)ccc3c2)cn1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.48
MTOR P42345 9/20 0.40
PIK3CA P42336 8/20 0.40
KCNH2 Q12809 2/20 0.39
HRH3 Q9Y5N1 2/20 0.39
ROCK2 O75116 1/20 0.39
ATM Q13315 5/20 0.38
ATR Q13535 3/20 0.38
NAAA Q02083 1/20 0.38
LTA4H P09960 1/20 0.38
GPR84 Q9NQS5 1/20 0.37
DPP4 P27487 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
ERN1 O75460 1/20 0.37
PIK3CD O00329 1/20 0.37

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
SCHEMBL14076937 0.85 HSD11B1 (0.45) HSD11B1HRH3ROCK2ATMLTA4H
SCHEMBL4696670 0.85 HSD11B1 (0.51) HSD11B1KCNH2HRH3ROCK2LTA4H
SCHEMBL3540597 0.83 HSD11B1 (0.43) HSD11B1MTORPIK3CAKCNH2HRH3
SCHEMBL4698838 0.83 HSD11B1 (0.60) HSD11B1
SCHEMBL4696609 0.81 HSD11B1 (0.57) HSD11B1
SCHEMBL4701592 0.80 HSD11B1 (0.49) HSD11B1ATM
SCHEMBL4696979 0.80 HSD11B1 (0.51) HSD11B1KCNH2HRH3ROCK2LTA4H
SCHEMBL4700534 0.77 HSD11B1 (0.48) HSD11B1ATM
SCHEMBL4696657 0.77 HSD11B1 (0.56) HSD11B1ROCK2
SCHEMBL4751912 0.77 HSD11B1 (0.56) HSD11B1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214621-A1 Cycloalkyl Lactam Derivatives As Inhibitors Of 11-Beta-Hydroxysteroid Dehydrogenase 1 ELI LILLY AND COMPANY 2008-09-04 US claimed
EP-1830841-B1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2008-07-02 EP claimed
EP-1830841-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-09-12 EP claimed
WO-2006068992-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2006-06-29 WO claimed
US-20080214621-A1 Cycloalkyl Lactam Derivatives As Inhibitors Of 11-Beta-Hydroxysteroid Dehydrogenase 1 ELI LILLY AND COMPANY 2008-09-04 US disclosed
US-20080214621-A1 Cycloalkyl Lactam Derivatives As Inhibitors Of 11-Beta-Hydroxysteroid Dehydrogenase 1 ELI LILLY AND COMPANY 2008-09-04 US disclosed
EP-1830841-B1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2008-07-02 EP disclosed
EP-1830841-B1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2008-07-02 EP 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-20080214621-A1 Cycloalkyl Lactam Derivatives As Inhibitors Of 11-Beta-Hydroxysteroid Dehydrogenase 1 HSD11B1, HSD17B1, HSD3B1 HSD11B1 1/4885MTOR 221/4885PIK3CA 529/4885

“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.