SCHEMBL6672759

SCHEMBL6672759

COC(=O)[C@H]1Cc2ccccc2N1C(=O)CCC1Cc2ccccc2C12CCNCC2

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.46
DRD4 P21917 2/20 0.46
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL6672242 0.87 AKT1 (0.40)
SCHEMBL6672515 0.87 AKT1 (0.40)
SCHEMBL6673179 0.84 POLB (0.42) ALDH1A1KDM4E
SCHEMBL6670425 0.82 TP53 (0.42)
SCHEMBL6674849 0.80 NOTUM (0.38)
SCHEMBL6669410 0.77 MC4R (0.42) DRD2DRD4
SCHEMBL6673527 0.76 DRD2 (0.42) DRD2DRD4ALDH1A1
Hydrochloric Acid SCHEMBL6669828 0.73 HTR2A (0.36) DRD2
SCHEMBL6672827 0.73 OPRM1 (0.43)
Hydrochloric Acid SCHEMBL6668923 0.73 HTR2A (0.35) DRD2

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-1399432-A1 SPIROPIPERIDINE COMPOUNDS AS LIGANDS FOR ORL-1 RECEPTOR PFIZER INC. (US) 2004-03-24 EP disclosed
WO-2003000677-A1 SPIROPIPERIDINE COMPOUNDS AS LIGANDS FOR ORL-1 RECEPTOR PFIZER PHARMACEUTICALS INC. (JP) 2003-01-03 WO disclosed