SCHEMBL10233166

SCHEMBL10233166

CCCN(CCC)C1CCCN(CC)C1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 15/20 0.39
DRD2 P14416 3/20 0.38
DRD4 P21917 3/20 0.38
BCHE P06276 1/20 0.36

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
SCHEMBL12104200 0.89 DRD3 (0.41) DRD3DRD2DRD4
SCHEMBL13456739 0.86 DRD3 (0.40) DRD3DRD2DRD4BCHE
SCHEMBL10233158 0.85 HTR2A (0.35) DRD3DRD2BCHE
SCHEMBL689341 0.79 SIGMAR1 (0.40) DRD3DRD2DRD4BCHE
SCHEMBL12568633 0.79 SIGMAR1 (0.36) DRD3DRD2BCHE
SCHEMBL255944 0.79 SIGMAR1 (0.36) DRD3DRD2BCHE
SCHEMBL689340 0.78 DRD3 (0.36) DRD3DRD2DRD4
SCHEMBL12104157 0.76 DRD3 (0.44) DRD3DRD2DRD4
SCHEMBL12104149 0.76 CYP3A4 (0.35) DRD3DRD2
SCHEMBL15865807 0.75 DRD3 (0.48) DRD3DRD2DRD4

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
EP-2323980-B1 7-(PIPERAZINE-1-YMETHYL)-1H-INDOLE-2-CARBOXYLIC ACID (PHENYL)-AMIDE DERIVATIVES AND ALLIED COMPOUNDS AS P38 MAP KINASE INHIBITORS FOR THE TREATMENT OF RESPIRATORY DISEASES BOEHRINGER INGELHEIM INT (DE) 2012-02-29 EP disclosed
US-20110269737-A1 7-(Piperazine-1-Ymethyl)-1H-Indole-2-Carboxylic Acid (Phenyl)-Amide Derivatives and Allied Compounds as P38 Map Kinase Inhibitors for the Treatment of Respiratory Diseases BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-03 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-20110269737-A1 7-(Piperazine-1-Ymethyl)-1H-Indole-2-Carboxylic Acid (Phenyl)-Amide Derivatives and Allied Compounds as P38 Map Kinase Inhibitors for the Treatment of Respiratory Diseases MAPKAPK2, MAPKAPK5, MAPK7 DRD3 2631/4885DRD2 2426/4885DRD4 4085/4885

“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.