SCHEMBL4669577

SCHEMBL4669577

Cc1ccc2cc(N3CCC(C(=O)N4CCCN(C5CCC5)CC4)C3)ccc2n1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.44
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 1/20 0.43
HRH3 Q9Y5N1 15/20 0.40
KDM2B Q8NHM5 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
SCHEMBL4668284 1.00 NOTUM (0.44) NOTUMLMNAHTTL3MBTL1MAPT
SCHEMBL4666723 1.00 NOTUM (0.44) NOTUMLMNAHTTL3MBTL1MAPT
Hydrochloric Acid SCHEMBL5223187 0.99 NOTUM (0.43) NOTUMLMNAHTTL3MBTL1MAPT
Hydrochloric Acid SCHEMBL4668601 0.99 NOTUM (0.43) NOTUMLMNAHTTL3MBTL1MAPT
Hydrochloric Acid SCHEMBL4669559 0.99 NOTUM (0.43) NOTUMLMNAHTTL3MBTL1MAPT
SCHEMBL4668289 0.79 ALDH1A1 (0.46) HRH3KDM2B
SCHEMBL4666725 0.79 ALDH1A1 (0.46) HRH3KDM2B
SCHEMBL4666761 0.79 MAPT (0.61) NOTUMLMNAL3MBTL1MAPTHRH3
SCHEMBL4666758 0.79 MAPT (0.61) NOTUMLMNAL3MBTL1MAPTHRH3
SCHEMBL4669602 0.79 MAPT (0.61) NOTUMLMNAL3MBTL1MAPTHRH3

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-1802307-B1 PYRROLIDINE DERIVATIVES AS HISTAMINE RECEPTORS LIGANDS GLAXO GROUP LTD (GB) 2008-02-27 EP disclosed
US-20080045506-A1 Pyrrolidine Derivatives as Histamine Receptors Ligands GLAXO GROUP LIMITED (GB) 2008-02-21 US disclosed
US-20080045506-A1 Pyrrolidine Derivatives as Histamine Receptors Ligands GLAXO GROUP LIMITED (GB) 2008-02-21 US disclosed
US-20080045506-A1 Pyrrolidine Derivatives as Histamine Receptors Ligands GLAXO GROUP LIMITED (GB) 2008-02-21 US disclosed
EP-1802307-A1 PYRROLIDINE DERIVATIVES AS HISTAMINE RECEPTORS LIGANDS GLAXO GROUP LIMITED (GB) 2007-07-04 EP disclosed
WO-2006040192-A1 PYRROLIDINE DERIVATIVES AS HISTAMINE RECEPTORS LIGANDS GLAXO GROUP LIMITED (GB) 2006-04-20 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-20080045506-A1 Pyrrolidine Derivatives as Histamine Receptors Ligands HRH4, HRH3, HRH2 NOTUM 1590/4885LMNA 4820/4885HTT 207/4885

“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.