SCHEMBL3316868

SCHEMBL3316868

COc1cc(N)c(Cl)cc1C(=O)NC1CCN(C(C)C2CCN(C(=O)C(C)C)CC2)CC1OC

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 20/20 0.73
KCNH2 Q12809 7/20 0.62

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
SCHEMBL4497794 0.85 HTR4 (1.00) HTR4KCNH2
SCHEMBL5393738 0.85 HTR4 (0.65) HTR4KCNH2
SCHEMBL3314657 0.85 HTR4 (1.00) HTR4KCNH2
SCHEMBL4476539 0.85 HTR4 (1.00) HTR4KCNH2
SCHEMBL3316732 0.85 HTR4 (1.00) HTR4KCNH2
SCHEMBL3314658 0.85 HTR4 (1.00) HTR4KCNH2
Hydrochloric Acid SCHEMBL3316620 0.84 HTR4 (0.98) HTR4KCNH2
Hydrochloric Acid SCHEMBL3316618 0.84 HTR4 (0.98) HTR4KCNH2
Hydrochloric Acid SCHEMBL3316629 0.84 HTR4 (0.98) HTR4KCNH2
SCHEMBL3316881 0.83 HTR4 (0.85) HTR4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105727-A1 NOVEL BENZAMIDE DERIVATIVES AND PROCESS FOR THE PREPARTION THEREOF DONG-A-PHARM. CO., LTD. (KR) 2010-04-29 US claimed

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-20100105727-A1 NOVEL BENZAMIDE DERIVATIVES AND PROCESS FOR THE PREPARTION THEREOF HTR4, HTR1A, TPH1 HTR4 1/4885KCNH2 126/4885

“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.