SCHEMBL3728329

SCHEMBL3728329

Cc1nc2cc(F)ccc2n1Cc1ccc(C(=O)N(C)C2CCN(C3CCC3)C2)cc1

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 19/20 0.80
PTAFR P25105 1/20 0.60
KCNH2 Q12809 3/20 0.56

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
SCHEMBL3728327 1.00 HRH3 (0.80) HRH3PTAFRKCNH2
SCHEMBL3725370 0.93 HRH3 (0.80) HRH3PTAFRKCNH2
SCHEMBL3725372 0.93 HRH3 (0.80) HRH3PTAFRKCNH2
SCHEMBL4943972 0.93 HRH3 (0.71) HRH3PTAFRKCNH2
SCHEMBL3667998 0.92 HRH3 (0.81) HRH3PTAFRKCNH2
SCHEMBL3667994 0.92 HRH3 (0.81) HRH3PTAFRKCNH2
SCHEMBL4944082 0.89 HRH3 (0.76) HRH3PTAFRKCNH2
SCHEMBL4944088 0.89 HRH3 (0.76) HRH3PTAFRKCNH2
SCHEMBL3674255 0.89 HRH3 (0.69) HRH3PTAFRKCNH2
SCHEMBL3674252 0.89 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293771-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-11-27 US claimed
EP-2155719-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS Wyeth LLC (US) 2010-02-24 EP disclosed
WO-2008147945-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-12-04 WO disclosed
US-20080293771-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2008-11-27 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-20080293771-A1 AZACYCLYLBENZAMIDE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS HRH4, HRH3, HRH2 HRH3 2/4885PTAFR 841/4885KCNH2 581/4885

“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.