SCHEMBL87838

SCHEMBL87838

CC(C)(C)c1c[nH]c(=O)n1[C@@H]1C[C@@H]2CCC1C2

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 2/20 0.40
HSD11B1 P28845 1/20 0.39
CYP11B2 P19099 1/20 0.34
ADORA2A P29274 2/20 0.34
JAK1 P23458 5/20 0.33
JAK2 O60674 1/20 0.33
TYK2 P29597 1/20 0.33
JAK3 P52333 1/20 0.33
CDK4 P11802 2/20 0.33
CCND1 P24385 2/20 0.33
CCND2 P30279 2/20 0.33
CCND3 P30281 2/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.31
OPRL1 P41146 1/20 0.31

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
SCHEMBL87413 0.70 HCAR1 (0.43) HCAR1HSD11B1CYP11B2ADORA2AMEN1
SCHEMBL87414 0.70 HCAR1 (0.43) HCAR1HSD11B1CYP11B2ADORA2AMEN1
SCHEMBL87839 0.70 HCAR1 (0.43) HCAR1HSD11B1CYP11B2ADORA2AMEN1
SCHEMBL11816411 0.69 HCAR1 (0.43) HCAR1CYP11B2ADORA2AJAK1JAK2
SCHEMBL11816421 0.68 HCAR1 (0.45) HCAR1HSD11B1CYP11B2ADORA2AJAK1
SCHEMBL11838497 0.62 HCAR1 (0.43) HCAR1CYP11B2ADORA2AJAK1JAK2
SCHEMBL6971456 0.62 LMNA (0.48) HCAR1ADORA2AMEN1KMT2AKDM4E
SCHEMBL11845235 0.62 HCAR1 (0.43) HCAR1CYP11B2ADORA2AJAK1JAK2
SCHEMBL4147813 0.62 ADORA2A (0.41) HCAR1HSD11B1CYP11B2ADORA2ACDK4
SCHEMBL2169792 0.60 CYP11B2 (0.41) HCAR1HSD11B1CYP11B2ADORA2AMEN1

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-8129423-B2 1-Adamantan-2-yl-3-benzyl-1,3-dihydro-imidazol-2-one; 11beta-hydroxysteroid dehydrogenases (11beta-HSD) inhibitor; antidiabetic, hypotensive, hypoglycemic agent; resist hyperglycemia provoked by obesity or stress; HOFFMAN-LA ROCHE INC. (US) 2012-03-06 US disclosed
US-20080103183-A1 NEW IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS HOFFMANN-LA ROCHE INC. 2008-05-01 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-20080103183-A1 NEW IMIDAZOLONE AND IMIDAZOLIDINONE DERIVATIVES AS 11B-HSD1 INHIBITORS HSD11B1, HSD17B1, HSD17B11 HCAR1 1331/4885HSD11B1 1/4885CYP11B2 16/4885

“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.