SCHEMBL241094

SCHEMBL241094

O=C(c1ccc(OC2CCNC2)cc1)N1CC2CCC(CC2)C1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 5/20 0.52
CHRNB4 P30926 5/20 0.52
CHRNA3 P32297 5/20 0.52
CHRNA4 P43681 5/20 0.52
CHRNA7 P36544 4/20 0.52
BCL9 O00512 6/20 0.48
CTNNB1 P35222 6/20 0.48
KMT2A Q03164 2/20 0.42

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
SCHEMBL16354314 0.81 KDM4E (0.48) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL3777801 0.81 KDM4E (0.48) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL912286 0.81 KDM4E (0.48) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL20165032 0.79 ALDH1A1 (0.57) CHRNB2CHRNA4
SCHEMBL20165033 0.79 ALDH1A1 (0.57) CHRNB2CHRNA4
SCHEMBL3133910 0.77 PARP10 (0.64) CHRNB2CHRNA4
SCHEMBL240882 0.77 GAA (0.52) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7
SCHEMBL4449045 0.76 KMT2A (0.50) KMT2A
Hydrochloric Acid SCHEMBL3127575 0.76 PARP10 (0.62) CHRNB2CHRNA4BCL9CTNNB1
SCHEMBL237663 0.75 GAA (0.47) CHRNB2CHRNB4CHRNA3CHRNA4CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120004209-A1 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HIGH POINT PHARMACEUTICALS, LLC (US) 2012-01-05 US disclosed
US-8053447-B2 11β-hydroxysteroid dehydrogenase type 1 active compounds HIGH POINT PHARMACEUTICALS, LLC (US) 2011-11-08 US disclosed
US-20100292215-A1 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC (US) 2010-11-18 US disclosed
EP-2010479-A1 11 BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS High Point Pharmaceuticals, LLC (US) 2009-01-07 EP disclosed
WO-2007115935-A1 11β-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC (US) 2007-10-18 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 (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-20120004209-A1 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HSD11B1, HSD3B1, HSD11B2 CHRNB2 2194/4885CHRNB4 2315/4885CHRNA3 2838/4885
US-20100292215-A1 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HSD11B1, HSD3B1, HSD17B1 CHRNB2 2346/4885CHRNB4 2459/4885CHRNA3 3017/4885

“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.