SCHEMBL5776673

SCHEMBL5776673

NC(=O)OC[C@@H]1CN(Cc2ccc(Cl)c(Cl)c2)CCO1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 19/20 0.64
▸ CCR3 P51677 1/20 0.59
▸ DRD2 P14416 1/20 0.51

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
SCHEMBL24087485 0.82 CCR3 (0.73) DRD4CCR3DRD2
Oxalic Acid SCHEMBL17891318 0.81 DRD4 (0.60) DRD4CCR3DRD2
SCHEMBL4026839 0.80 DRD4 (0.65) DRD4CCR3
SCHEMBL1809499 0.80 DRD4 (0.65) DRD4CCR3
SCHEMBL4031677 0.80 DRD4 (0.65) DRD4CCR3
Hydrochloric Acid SCHEMBL1809455 0.79 DRD4 (0.63) DRD4CCR3
SCHEMBL5771404 0.79 CCR3 (0.79) DRD4CCR3
Oxalic Acid SCHEMBL6163601 0.79 DRD4 (0.89) DRD4DRD2
SCHEMBL4496185 0.78 CCR3 (0.68) DRD4CCR3DRD2
SCHEMBL3922376 0.78 CCR3 (0.68) DRD4CCR3DRD2

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
EP-1324991-B1 COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LTD (GB) 2006-11-15 — — EP claimed
Send feedback