SCHEMBL4450573

SCHEMBL4450573

CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)N1CCCN(C2CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 14/20 0.46
KCNH2 Q12809 3/20 0.46
PREP P48147 2/20 0.45
HSD17B10 Q99714 1/20 0.45
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
HPGD P15428 1/20 0.41

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
SCHEMBL4447020 0.97 HRH3 (0.50) HRH3KCNH2HSD17B10
SCHEMBL4448614 0.97 HRH3 (0.50) HRH3KCNH2HSD17B10
SCHEMBL4448644 0.97 HRH3 (0.48) HRH3KCNH2PREPHSD17B10HPGD
SCHEMBL4453012 0.97 HRH3 (0.50) HRH3KCNH2HSD17B10
SCHEMBL4450543 0.93 HSD17B10 (0.46) HRH3KCNH2PREPHSD17B10CHRM2
SCHEMBL4449652 0.93 HSD17B10 (0.46) HRH3KCNH2PREPHSD17B10CHRM2
SCHEMBL2496643 0.89 HSD17B10 (0.50) PREPHSD17B10CHRM2CHRM1CHRM3
SCHEMBL13462044 0.87 HPGD (0.50) PREPHSD17B10CHRM2CHRM1CHRM3
SCHEMBL2709135 0.87 HPGD (0.50) PREPHSD17B10CHRM2CHRM1CHRM3
SCHEMBL7142429 0.85 HPGD (0.52) PREPHSD17B10CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8236792-B2 Substituted pyrrolidine amides as modulators of the histamine H3 receptor JANSSEN PHARMACEUTICA NV (BE) 2012-08-07 US claimed
US-20090291903-A1 SUBSTITUTED PYRROLIDINE AMIDES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-11-26 US claimed
US-8236792-B2 Substituted pyrrolidine amides as modulators of the histamine H3 receptor JANSSEN PHARMACEUTICA NV (BE) 2012-08-07 US disclosed
US-8236792-B2 Substituted pyrrolidine amides as modulators of the histamine H3 receptor JANSSEN PHARMACEUTICA NV (BE) 2012-08-07 US disclosed
US-8236792-B2 Substituted pyrrolidine amides as modulators of the histamine H3 receptor JANSSEN PHARMACEUTICA NV (BE) 2012-08-07 US disclosed
WO-2009143153-A1 SUBSTITUTED PYRROLIDINE AMIDES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2009-11-26 WO disclosed
US-20090291903-A1 SUBSTITUTED PYRROLIDINE AMIDES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-11-26 US disclosed
US-20090291903-A1 SUBSTITUTED PYRROLIDINE AMIDES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-11-26 US disclosed
US-20090291903-A1 SUBSTITUTED PYRROLIDINE AMIDES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-11-26 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-20090291903-A1 SUBSTITUTED PYRROLIDINE AMIDES AS MODULATORS OF THE HISTAMINE H3 RECEPTOR HRH3, HRH4, HRH2 HRH3 1/4885KCNH2 1338/4885PREP 484/4885

“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.