SCHEMBL10072278

SCHEMBL10072278

COc1cc(Cl)c(CC2CCN(C3CC=C(F)CC3)C2=O)c(Cl)c1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.34
HTR2B P41595 3/20 0.34
HTR2A P28223 1/20 0.34
CYP24A1 Q07973 4/20 0.33
CYP27A1 Q02318 3/20 0.33
HSD11B1 P28845 1/20 0.33
CYP26A1 O43174 1/20 0.33
KDM4E B2RXH2 1/20 0.33
KMT2A Q03164 1/20 0.33
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
P2RX7 Q99572 1/20 0.32
HTR1A P08908 1/20 0.31
SLC6A4 P31645 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
SCHEMBL474803 0.92 OPRM1 (0.39) HTR2CHTR2BCYP24A1CYP27A1HSD11B1
SCHEMBL474782 0.85 HSD11B1 (0.39) HTR2CHTR2BHTR2ACYP24A1CYP27A1
SCHEMBL474858 0.82 HSD11B1 (0.38) HTR2CHTR2BHTR2ACYP24A1CYP27A1
SCHEMBL474859 0.82 HSD11B1 (0.38) HTR2CHTR2BHTR2ACYP24A1CYP27A1
SCHEMBL208406 0.82 HSD11B1 (0.51) HTR2CHTR2BHTR2AHSD11B1KDM4E
SCHEMBL13675619 0.82 HSD11B1 (0.36) HTR2CHTR2BHTR2ACYP24A1CYP27A1
SCHEMBL2994422 0.80 HSD11B1 (0.38) HTR2CHTR2BHTR2ACYP24A1HSD11B1
SCHEMBL2997454 0.80 HSD11B1 (0.38) HTR2CHTR2BHTR2ACYP24A1HSD11B1
SCHEMBL4515440 0.77 FFAR4 (0.37) HTR2CHTR2BHTR2ACYP24A1HSD11B1
SCHEMBL2204952 0.77 OPRM1 (0.42) CYP24A1CYP27A1HSD11B1CYP26A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049475-B1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2012-02-01 EP disclosed
US-7998999-B2 Cyclohexyl substituted pyrrolidinones as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2011-08-16 US disclosed
US-7998999-B2 Cyclohexyl substituted pyrrolidinones as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2011-08-16 US disclosed
US-20090239911-A1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-09-24 US disclosed
US-20090239911-A1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-09-24 US disclosed
WO-2007127704-A1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-08 WO 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-20090239911-A1 CYCLOHEXYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD17B1, HSD3B1 HTR2C 1343/4885HTR2B 1454/4885HTR2A 1128/4885

“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.