SCHEMBL6330610

SCHEMBL6330610

O=C=Nc1c(Cl)cc(Br)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NMT1 P30419 1/20 0.39
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38

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
SCHEMBL17027567 0.86 GABRA1 (0.36) MAPK1TDP1NMT1GABRA1GABRB2
SCHEMBL29648901 0.86 GABRA1 (0.36) MAPK1TDP1NMT1GABRA1GABRB2
SCHEMBL10614885 0.83 GABRA1 (0.50) MAPK1TDP1NMT1GABRA1GABRB2
SCHEMBL11322087 0.82 GABRA1 (0.42) MAPK1TDP1GABRA1GABRB2
SCHEMBL1019709 0.81 MAPK1 (0.45) MAPK1TDP1GABRA1GABRB2
SCHEMBL5206535 0.79 MAPK1 (0.59) MAPK1TDP1GABRA1GABRB2
SCHEMBL1950823 0.77 MAPK1 (0.42) MAPK1TDP1GABRA1GABRB2
SCHEMBL9834243 0.77 MAPK1 (0.38) MAPK1TDP1GABRA1GABRB2
SCHEMBL8641955 0.76 MAPK1 (0.50) MAPK1TDP1GABRA1GABRB2
SCHEMBL2728021 0.76 TDP1 (0.36) MAPK1TDP1GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050085509-A1 Piperidin-2-one derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO. LTD. (JP) 2005-04-21 US disclosed
CN-1578767-A Piperidin-2-one derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO (JP) 2005-02-09 CN disclosed
EP-1447401-A1 PIPERIDIN-2-ONE DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-08-18 EP 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-20050085509-A1 Piperidin-2-one derivative compounds and drugs containing these compounds as the active ingredient MAPKAP1, MAPK1, MAPK8 MAPK1 2/4885TDP1 1960/4885NMT1 3387/4885

“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.