SCHEMBL4946579

SCHEMBL4946579

COc1cc(Cn2cnc3ccccc32)ccc1C(=O)N(C)C1CCN(C2CCCC2)CC1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 17/20 0.66
CSF1R P07333 1/20 0.46
KCNH2 Q12809 2/20 0.41
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
MCHR1 Q99705 1/20 0.40

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
SCHEMBL4941878 0.94 HRH3 (0.73) HRH3CSF1RKCNH2
SCHEMBL3722065 0.94 HRH3 (0.73) HRH3CSF1RKCNH2
SCHEMBL3720942 0.93 HRH3 (0.65) HRH3CSF1RKCNH2
SCHEMBL3726164 0.88 HRH3 (0.68) HRH3KCNH2LMNAHTT
SCHEMBL4937192 0.88 HRH3 (0.65) HRH3CSF1RKCNH2LMNAHTT
SCHEMBL3728789 0.85 HRH3 (0.66) HRH3KCNH2
SCHEMBL3726628 0.85 HRH3 (0.73) HRH3CSF1RKCNH2LMNAHTT
SCHEMBL4945899 0.85 HRH3 (0.73) HRH3CSF1RKCNH2LMNAHTT
SCHEMBL3666533 0.84 HRH3 (0.90) HRH3KCNH2
SCHEMBL4943231 0.83 HRH3 (0.90) HRH3KCNH2

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 2 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
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 2/4885CSF1R 947/4885KCNH2 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.