SCHEMBL4667230

SCHEMBL4667230

CCC(CC)N1CCN(C(=O)[C@H]2CCN(C(=O)O)C2)CC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.43
HSD11B1 P28845 1/20 0.42
ALDH1A1 P00352 6/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 2/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.40
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL4668405 0.83 HRH3 (0.60) HRH3ALDH1A1SMN1; SMN2TSHRCNR1
SCHEMBL4667221 0.80 HSD11B1 (0.66) HSD11B1ALDH1A1SMN1; SMN2KDM4ETSHR
SCHEMBL27571754 0.79 KDM4E (0.53) HRH3ALDH1A1KDM4ETP53MEN1
SCHEMBL4668594 0.78 HRH3 (0.55) HRH3ALDH1A1SMN1; SMN2TSHRCNR1
SCHEMBL28735731 0.76 HPGD (0.63) ALDH1A1SMN1; SMN2KDM4ETSHRMEN1
SCHEMBL20521101 0.76 HPGD (0.63) ALDH1A1SMN1; SMN2KDM4ETSHRMEN1
SCHEMBL28249899 0.74 SMN1; SMN2 (0.46) HSD11B1ALDH1A1SMN1; SMN2KDM4ETSHR
SCHEMBL28249896 0.74 SMN1; SMN2 (0.46) HSD11B1ALDH1A1SMN1; SMN2KDM4ETSHR
SCHEMBL4669527 0.73 CHRNB2 (0.41) HRH3HSD11B1ALDH1A1KDM4ETP53
SCHEMBL5226183 0.73 CHRNB2 (0.41) HRH3HSD11B1ALDH1A1KDM4ETP53

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 4 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
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 HRH3 2/4885HSD11B1 3368/4885ALDH1A1 1039/4885

“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.