SCHEMBL6092318

SCHEMBL6092318

CC(C)(C(=O)NC1C2CC3CC(C2)CC1C3)c1cccc(OCCN2CCOCC2)c1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
EPHX2 P34913 15/20 0.47
HSD11B1 P28845 1/20 0.43

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
SCHEMBL12586302 0.91 EPHX2 (0.51) KDM4EEPHX2HSD11B1
SCHEMBL4827794 0.90 HSD11B1 (0.59) KDM4ETP53TSHREPHX2HSD11B1
SCHEMBL12586217 0.90 HSD11B1 (0.59) KDM4ETP53TSHREPHX2HSD11B1
SCHEMBL12586465 0.89 HSD11B1 (0.47) KDM4ETP53TSHREPHX2HSD11B1
SCHEMBL3185119 0.88 HSD11B1 (0.59) EPHX2HSD11B1
SCHEMBL12585771 0.84 HSD11B1 (0.46) EPHX2HSD11B1
SCHEMBL12586435 0.83 HSD11B1 (0.44) HSD11B1
SCHEMBL12585861 0.82 HSD11B1 (0.47) KDM4EHSD11B1
SCHEMBL6688873 0.81 HSD11B1 (0.48) KDM4EEPHX2HSD11B1
SCHEMBL6092831 0.80 HSD11B1 (0.50) EPHX2HSD11B1

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
EP-1581476-B1 AMIDES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2016-11-16 EP claimed
US-20060079506-A1 Adamantyl acetamides as 11-beta hydroxysteroid dehydrogenase inhibitors JANSSEN PHARMACEUTICAL N.V. (BE) 2006-04-13 US claimed
WO-2004056744-A1 ADAMANTYL ACETAMIDES AS HYDROXYSTEROID DEHYDROGENASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2004-07-08 WO claimed

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-20060079506-A1 Adamantyl acetamides as 11-beta hydroxysteroid dehydrogenase inhibitors DHCR7, HSD3B2, HSD3B1 KDM4E 4303/4885TP53 4282/4885TSHR 905/4885

“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.