SCHEMBL7599223

SCHEMBL7599223

Cc1ccc(C)c(N2CCN(CCCNC(=O)C(C)(O)c3ccc4ccccc4c3)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.56
DRD3 P35462 4/20 0.56
DRD4 P21917 2/20 0.56
ADRA1A P35348 3/20 0.54
POLB P06746 3/20 0.54
MAPK1 P28482 1/20 0.54
MAPT P10636 5/20 0.53
TP53 P04637 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
SLC6A2 P23975 1/20 0.52
SLC6A4 P31645 1/20 0.52
LMNA P02545 2/20 0.52
ALDH1A1 P00352 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
HTT P42858 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ADRA1D P25100 1/20 0.48
ADRA1B P35368 1/20 0.48
GSK3B P49841 2/20 0.48

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
SCHEMBL7596945 0.90 DRD2 (0.59) DRD2DRD3DRD4ADRA1APOLB
SCHEMBL7600856 0.90 DRD2 (0.59) DRD2DRD3DRD4ADRA1APOLB
SCHEMBL7601672 0.90 DRD2 (0.59) DRD2DRD3DRD4ADRA1APOLB
SCHEMBL7604922 0.90 DRD2 (0.61) DRD2DRD3DRD4ADRA1APOLB
SCHEMBL7600056 0.86 DRD3 (0.54) DRD2DRD3DRD4ADRA1APOLB
SCHEMBL7597598 0.86 MAPT (0.58) DRD2DRD3DRD4POLBMAPK1
SCHEMBL7601978 0.86 POLB (0.69) DRD2DRD3DRD4POLBMAPK1
SCHEMBL7601112 0.86 MAPT (0.68) DRD2DRD3DRD4POLBMAPK1
SCHEMBL7601141 0.85 MAPT (0.61) DRD2DRD3DRD4POLBMAPK1
SCHEMBL7603601 0.85 DRD3 (0.57) DRD2DRD3DRD4ADRA1APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891344-B1 ALPHA-1 ADRENERGIC RECEPTOR ANTAGONISTS SOD CONSEILS RECH APPLIC (FR) 2002-12-18 EP disclosed
US-6300499-B1 α1-adrenergic receptor antagonists SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2001-10-09 US disclosed
EP-0891344-A1 ALPHA 1-ADRENERGIC RECEPTOR ANTAGONISTS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 1999-01-20 EP disclosed
WO-1997037983-A1 α1-ADRENERGIC RECEPTOR ANTAGONISTS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 1997-10-16 WO disclosed