SCHEMBL5414844

SCHEMBL5414844

O=C(c1ccc2c(c1)cc(C(=O)N1CCCCC1)n2CC(F)(F)F)N1CCN(C2CCC2)CC1

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.84
L3MBTL3 Q96JM7 6/20 0.48
L3MBTL1 Q9Y468 5/20 0.48
HTT P42858 1/20 0.44
MBTD1 Q05BQ5 2/20 0.44

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
SCHEMBL3542210 0.92 HRH3 (1.00) HRH3L3MBTL3L3MBTL1
SCHEMBL3542263 0.91 HRH3 (0.79) HRH3L3MBTL3L3MBTL1HTT
SCHEMBL3537010 0.91 HRH3 (0.79) HRH3L3MBTL3L3MBTL1HTT
SCHEMBL3544224 0.91 HRH3 (0.95) HRH3L3MBTL3L3MBTL1HTT
SCHEMBL3538056 0.90 HRH3 (0.96) HRH3L3MBTL3L3MBTL1
SCHEMBL3536090 0.89 HRH3 (0.76) HRH3L3MBTL3L3MBTL1HTT
SCHEMBL3543910 0.89 HRH3 (0.76) HRH3L3MBTL3L3MBTL1HTT
SCHEMBL3538862 0.86 HRH3 (0.67) HRH3L3MBTL3L3MBTL1MBTD1
SCHEMBL3541810 0.85 HRH3 (0.68) HRH3L3MBTL3L3MBTL1MBTD1
SCHEMBL3539650 0.85 HRH3 (0.87) HRH3L3MBTL3L3MBTL1

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-20070244125-A1 5-amido-indole-2-carboxamide derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-10-18 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-20070244125-A1 5-amido-indole-2-carboxamide derivatives HRH4, HRH3, CNR2 HRH3 2/4885L3MBTL3 3467/4885L3MBTL1 3202/4885

“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.