SCHEMBL1862840

SCHEMBL1862840

CC(C)N1CCN(C(=O)c2ccnc(Cl)c2)CC1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.57
HRH3 Q9Y5N1 14/20 0.52
CCNT1 O60563 1/20 0.49
CDK1 P06493 1/20 0.49
CDK2 P24941 1/20 0.49
CDK9 P50750 1/20 0.49
CDK6 Q00534 1/20 0.49
PROKR1 Q8TCW9 1/20 0.49
GFER P55789 1/20 0.47

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
SCHEMBL13149815 0.84 ALDH1A1 (0.53) HRH3PROKR1
SCHEMBL4059188 0.84 POLB (0.59) PROKR1GFER
SCHEMBL6179175 0.82 PROKR1 (0.53) PROKR1GFER
SCHEMBL939096 0.82 PROKR1 (0.63) PROKR1GFER
SCHEMBL937205 0.82 PROKR1 (0.63) PROKR1GFER
SCHEMBL1859158 0.80 PROKR1 (0.61) PROKR1GFER
SCHEMBL30667713 0.80 PROKR1 (0.61) PROKR1GFER
SCHEMBL7496576 0.80 SMN1; SMN2 (0.49) PROKR1GFER
SCHEMBL1857764 0.80 HRH3 (0.65) CHRNA7HRH3
SCHEMBL13503775 0.79 HPGD (0.67) CHRNA7HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947718-B2 Isoxazole compounds as histamine H3 modulators JANSSEN PHARMACEUTICA NV (BE) 2011-05-24 US disclosed
US-20100022539-A1 Isoxazole Compounds as Histamine H3 modulators JANSSEN PHARMACEUTICA NV (BE) 2010-01-28 US disclosed
US-20080306066-A1 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS CARRUTHERS NICHOLAS I 2008-12-11 US disclosed
US-7423147-B2 Pyridine compounds as histamine H3 modulators JANSSEN PHARMACEUTICAL, N.V. (BE) 2008-09-09 US disclosed
EP-1761496-A2 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS AS HISTAMINE H3-RECEPTOR LIGANDS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-14 EP disclosed
WO-2005097751-A2 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS AS HISTAMINE H3-RECEPTOR LIGANDS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-10-20 WO disclosed
US-20050222151-A1 Non-Imidazole heterocyclic compounds JANSSEN PHARMACEUTICAL, N.V. (BE) 2005-10-06 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 (3 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-20100022539-A1 Isoxazole Compounds as Histamine H3 modulators HRH3, HRH4, HRH1 CHRNA7 124/4885HRH3 1/4885CCNT1 4394/4885
US-20050222151-A1 Non-Imidazole heterocyclic compounds HRH3, HRH4, HRH2 CHRNA7 451/4885HRH3 1/4885CCNT1 2799/4885
US-20080306066-A1 NON-IMIDAZOLE HETEROCYCLIC COMPOUNDS HRH3, HRH4, HRH2 CHRNA7 451/4885HRH3 1/4885CCNT1 2799/4885

“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.