SCHEMBL879232

SCHEMBL879232

CC(=O)N1CCC2CCCCC2C1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.53
EPHX2 P34913 3/20 0.46
EPHX1 P07099 1/20 0.46
CHRNB2 P17787 1/20 0.45
CHRNB4 P30926 1/20 0.45
CHRNA3 P32297 1/20 0.45
CHRNA4 P43681 1/20 0.45
CNR2 P34972 12/20 0.43
MBTD1 Q05BQ5 1/20 0.39
L3MBTL3 Q96JM7 1/20 0.39

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
SCHEMBL18711711 1.00 HSD11B1 (0.53) HSD11B1EPHX2EPHX1CHRNB2CHRNB4
SCHEMBL18478535 1.00 HSD11B1 (0.53) HSD11B1EPHX2EPHX1CHRNB2CHRNB4
SCHEMBL18711710 1.00 HSD11B1 (0.53) HSD11B1EPHX2EPHX1CHRNB2CHRNB4
SCHEMBL6674224 0.87 CHRNB2 (0.58) HSD11B1EPHX2EPHX1CHRNB2CHRNB4
SCHEMBL6674226 0.87 CHRNB2 (0.58) HSD11B1EPHX2EPHX1CHRNB2CHRNB4
SCHEMBL6675552 0.87 CHRNB2 (0.58) HSD11B1EPHX2EPHX1CHRNB2CHRNB4
SCHEMBL11204345 0.85 HSD11B1 (0.59) HSD11B1EPHX2EPHX1CHRNB2CHRNB4
SCHEMBL11204341 0.85 HSD11B1 (0.59) HSD11B1EPHX2EPHX1CHRNB2CHRNB4
SCHEMBL17690703 0.84 HSD11B1 (0.50) HSD11B1EPHX2EPHX1CNR2MBTD1
SCHEMBL772491 0.83 HSD11B1 (0.56) HSD11B1CNR2MBTD1L3MBTL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3356345-B1 HETEROARYL DERIVATIVES AS SEPIAPTERIN REDUCTASE INHIBITORS MAX PLANCK GESELLSCHAFT (DE) 2023-11-08 EP disclosed
US-10328141-B2 Synthetic vaccines against Streptococcus pneumoniae type 1 MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2019-06-25 US disclosed
US-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-04-06 US disclosed
US-20160346374-A1 SYNTHETIC VACCINES AGAINST STREPTOCOCCUS PNEUMONIAE TYPE 1 MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2016-12-01 US disclosed
US-8952176-B2 Heterocyclic compound having type I 11 β hydroxysteroid dehydrogenase inhibitory activity SHIONOGI & CO., LTD. (JP) 2015-02-10 US disclosed
US-20120122854-A1 Carbocyclic Fused Cyclic Amines BOEHRINGER MARKUS (CH) 2012-05-17 US disclosed
EP-1894919-B1 HETEROCYCLIC COMPOUND HAVING TYPE I 11 BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORY ACTIVITY SHIONOGI & CO (JP) 2012-03-28 EP disclosed
US-8017638-B2 Isoxazole derivative and isothiazole derivative having inhibitory activity on 11β-hydroxysteroid dehydrogenase type 1 SHIONOGI & CO., LTD. (JP) 2011-09-13 US disclosed
US-7897601-B2 Cannabinoid receptor modulators INTERVET, INC. (US) 2011-03-01 US disclosed
US-20090131491-A1 ISOXAZOLE DERIVATIVE AND ISOTHIAZOLE DERIVATIVE HAVING INHIBITORY ACTIVITY ON 11(beta)-HYDROXYSTEROID DEHYDROGENASE TYPE I SHIONOGI & CO., LTD. (JP) 2009-05-21 US disclosed
EP-1894919-A1 HETEROCYCLIC COMPOUND HAVING TYPE I 11 BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2008-03-05 EP disclosed
US-20070197628-A1 Cannabinoid receptor modulators INTERVET INTERNATIONAL B.V. (NL) 2007-08-23 US disclosed
US-20070112012-A1 Carbocyclic fused cyclic amines F. HOFFMANN-LA ROCHE AG (CH) 2007-05-17 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 (7 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-20070112012-A1 Carbocyclic fused cyclic amines F12, F11, F2 HSD11B1 1716/4885EPHX2 809/4885EPHX1 1271/4885
US-20090131491-A1 ISOXAZOLE DERIVATIVE AND ISOTHIAZOLE DERIVATIVE HAVING INHIBITORY ACTIVITY ON 11(beta)-HYDROXYSTEROID DEHYDROGENASE TYPE I HSD3B1, NR5A1, HSD11B1 HSD11B1 3/4885EPHX2 1668/4885EPHX1 1338/4885
US-20070197628-A1 Cannabinoid receptor modulators CNR1, CNR2, GPR18 HSD11B1 600/4885EPHX2 2025/4885EPHX1 1254/4885
US-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS SPR, QDPR, SRR HSD11B1 375/4885EPHX2 1398/4885EPHX1 950/4885
US-20120122854-A1 Carbocyclic Fused Cyclic Amines F12, F11, F2 HSD11B1 1716/4885EPHX2 809/4885EPHX1 1271/4885
US-20160346374-A1 SYNTHETIC VACCINES AGAINST STREPTOCOCCUS PNEUMONIAE TYPE 1 NEU1, ALG1, CSGALNACT1 HSD11B1 1935/4885EPHX2 4362/4885EPHX1 3959/4885
US-10328141-B2 Synthetic vaccines against Streptococcus pneumoniae type 1 NEU1, ALG1, CSGALNACT1 HSD11B1 1935/4885EPHX2 4362/4885EPHX1 3959/4885

“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.