SCHEMBL7083799

SCHEMBL7083799

CCCCCN1CCN(N2C(=O)c3ccccc3C2=O)CC1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.52
HTR1A P08908 4/20 0.50
SETD7 Q8WTS6 1/20 0.50
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
DRD2 P14416 1/20 0.47
DRD3 P35462 1/20 0.47

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
SCHEMBL8102565 0.95 MAOB (0.50) MAOBHTR1ADRD2DRD3
SCHEMBL8092753 0.89 DRD2 (0.49) MAOBHTR1ADRD2
Hydrochloric Acid SCHEMBL31491133 0.79 HTR1A (0.48) MAOBHTR1A
SCHEMBL6953084 0.78 MAOB (0.62) MAOBHTR1A
SCHEMBL6946848 0.78 MAOB (0.71) MAOBHTR1ADRD2DRD3
SCHEMBL30022123 0.78 POLB (0.54)
Hydrochloric Acid SCHEMBL31491177 0.76 SIGMAR1 (0.43) MAOBHTR1A
SCHEMBL14028451 0.75 HTR1A (0.79) MAOBHTR1ADRD2DRD3
SCHEMBL7688505 0.74 KDM4E (0.65) HTR1AKDM4ELMNADRD2DRD3
SCHEMBL45324 0.73 ALDH1A1 (0.67)

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-1346983-A3 Phthalimido arylpiperazines as alpha 1A receptor antagonists useful in the treatment of benign prostatic hyperplasia Ortho-Mcneil Pharmaceutical, Inc. (US) 2003-12-03 EP disclosed
EP-1346983-A2 Phthalimido arylpiperazines as alpha 1A receptor antagonists useful in the treatment of benign prostatic hyperplasia Ortho-Mcneil Pharmaceutical, Inc. (US) 2003-09-24 EP disclosed