SCHEMBL2886474

SCHEMBL2886474

Cc1nc2ccccc2n1Cc1ccc(C(=O)N2CCC(N(C)C)C2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 14/20 1.00
PTAFR P25105 2/20 0.62
HDAC1 Q13547 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
HRH1 P35367 2/20 0.54
KCNH2 Q12809 2/20 0.54
CYP2D6 P10635 1/20 0.54
CHRM1 P11229 1/20 0.52
GALR3 O60755 1/20 0.51
NR2F2 P24468 1/20 0.51

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
SCHEMBL2881658 0.90 HRH3 (1.00) HRH3PTAFRHRH1KCNH2CYP2D6
SCHEMBL2878779 0.90 HRH3 (1.00) HRH3PTAFRHRH1KCNH2CYP2D6
SCHEMBL2885885 0.90 HRH3 (1.00) HRH3PTAFRHRH1KCNH2CYP2D6
SCHEMBL2881282 0.83 HRH3 (1.00) HRH3PTAFRHDAC1HDAC6
SCHEMBL2878688 0.83 HRH3 (1.00) HRH3PTAFRHDAC1HDAC6
SCHEMBL2886071 0.83 HRH3 (0.71) HRH3HDAC1HDAC6
SCHEMBL1812862 0.83 HRH3 (0.71) HRH3KCNH2
SCHEMBL2886424 0.82 HRH3 (1.00) HRH3PTAFR
SCHEMBL2883495 0.81 HRH3 (1.00) HRH3HDAC1HDAC6
SCHEMBL3666267 0.80 HRH3 (0.69) HRH3PTAFRKCNH2

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
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US claimed
EP-1994022-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS Wyeth a Corporation of the State of Delaware (US) 2008-11-26 EP claimed
WO-2007108936-A2 N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2007-09-27 WO claimed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 US claimed
US-7820825-B2 N-substituted-azacyclylamines as histamine-3 antagonists WYETH LLC (US) 2010-10-26 US disclosed
US-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists WYETH (US) 2007-09-20 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-20070219240-A1 N-substituted-azacyclylamines as histamine-3 antagonists HNMT, HRH4, HRH3 HRH3 3/4885PTAFR 1160/4885HDAC1 701/4885

“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.