SCHEMBL4697041

SCHEMBL4697041

COC(=O)CCCOc1ccc2cc(CC3CCN(C4CCCCC4)C3=O)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.47
PDE3B Q13370 16/20 0.41
PDE3A Q14432 16/20 0.41
P2RY12 Q9H244 10/20 0.41
PDE2A O00408 5/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
PDE5A O76074 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
PTAFR P25105 1/20 0.41
CYP2C19 P33261 1/20 0.41
BLM P54132 1/20 0.41
PDE1A P54750 1/20 0.41
PDE1B Q01064 1/20 0.41
PMP22 Q01453 1/20 0.41

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
SCHEMBL4698585 0.90 HSD11B1 (0.53) HSD11B1PDE3BPDE3AP2RY12PDE2A
SCHEMBL4698838 0.84 HSD11B1 (0.60) HSD11B1MEN1KMT2AALDH1A1CYP1A2
SCHEMBL4699066 0.84 HSD11B1 (0.50) HSD11B1PDE3BPDE3AP2RY12MEN1
Hydrochloric Acid SCHEMBL4698625 0.83 HSD11B1 (0.49) HSD11B1PDE3BPDE3AP2RY12MEN1
SCHEMBL4697372 0.83 HSD11B1 (0.51) HSD11B1PDE3BPDE3AMEN1KMT2A
SCHEMBL4696609 0.82 HSD11B1 (0.57) HSD11B1MEN1KMT2AALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL5103842 0.82 HSD11B1 (0.50) HSD11B1PDE3BPDE3AMEN1KMT2A
SCHEMBL4698927 0.82 HSD11B1 (0.52) HSD11B1HRH3
SCHEMBL2998771 0.81 HSD11B1 (0.41) HSD11B1PDE3BPDE3AP2RY12PDE2A
Hydrochloric Acid SCHEMBL4698062 0.81 HSD11B1 (0.51) HSD11B1KMT2AHRH3

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 2 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 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 1/4885PDE3B 870/4885PDE3A 992/4885

“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.