SCHEMBL209043

SCHEMBL209043

CS(=O)(=O)OC1CCC(N2CCC(Cc3c(Cl)cc(-c4ccc(C(=O)N5CCC(C(F)(F)F)CC5)cc4)cc3Cl)C2=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 3/20 0.39
HTR2B P41595 2/20 0.35
RORC P51449 1/20 0.34
KMT2A Q03164 1/20 0.34
HRH3 Q9Y5N1 3/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
HSD11B1 P28845 2/20 0.33
NAMPT P43490 1/20 0.33
SPR P35270 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL209041 1.00 P2RX7 (0.39) P2RX7HTR2BRORCKMT2AHRH3
SCHEMBL209042 1.00 P2RX7 (0.39) P2RX7HTR2BRORCKMT2AHRH3
SCHEMBL208297 0.91 PARP1 (0.40) P2RX7HTR2BHRH3NAMPTSPR
SCHEMBL208299 0.91 PARP1 (0.40) P2RX7HTR2BHRH3NAMPTSPR
SCHEMBL208298 0.91 PARP1 (0.40) P2RX7HTR2BHRH3NAMPTSPR
SCHEMBL208557 0.89 HTR2B (0.37) HTR2BHRH3HSD11B1NAMPTSPR
SCHEMBL208559 0.89 HTR2B (0.37) HTR2BHRH3HSD11B1NAMPTSPR
SCHEMBL208929 0.89 HTR2B (0.37) HTR2BHRH3HSD11B1NAMPTSPR
SCHEMBL208558 0.89 HTR2B (0.37) HTR2BHRH3HSD11B1NAMPTSPR
SCHEMBL3127709 0.87 HRH3 (0.37) HTR2BHRH3HSD11B1NAMPTSPR

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-2016047-B1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11- BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2013-08-28 EP disclosed
US-8088776-B2 Biphenyl amide lactam derivatives as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2012-01-03 US disclosed
US-7816349-B2 Substituted pyrrolidinones as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2010-10-19 US disclosed
EP-2029529-B1 SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2010-07-07 EP disclosed
US-20090156571-A1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-06-18 US disclosed
US-20090069326-A1 SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-03-12 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 (2 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-20090069326-A1 SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD17B1, HSD3B1 P2RX7 4365/4885HTR2B 877/4885RORC 1070/4885
US-20090156571-A1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD17B1, HSD11B2 P2RX7 4609/4885HTR2B 656/4885RORC 542/4885

“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.