SCHEMBL7603601

SCHEMBL7603601

Cc1ccc(C)c(N2CCN(CCCNC(=O)C(C)(O)c3cccc4ccccc34)CC2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 7/20 0.57
DRD2 P14416 6/20 0.57
DRD4 P21917 2/20 0.57
FAAH O00519 4/20 0.53
CNR1 P21554 3/20 0.53
MAPT P10636 6/20 0.52
TP53 P04637 4/20 0.52
POLB P06746 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 2/20 0.51
MAPK1 P28482 1/20 0.51
ALDH1A1 P00352 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
HTT P42858 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
ADRA1B P35368 1/20 0.48
GSK3B P49841 2/20 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
SCHEMBL7601780 0.87 MAPT (0.58) DRD3DRD2DRD4MAPTTP53
SCHEMBL7601672 0.85 DRD2 (0.59) DRD3DRD2DRD4MAPTTP53
SCHEMBL7600856 0.85 DRD2 (0.59) DRD3DRD2DRD4MAPTTP53
SCHEMBL7596945 0.85 DRD2 (0.59) DRD3DRD2DRD4MAPTTP53
SCHEMBL7599223 0.85 DRD2 (0.56) DRD3DRD2DRD4MAPTTP53
SCHEMBL7604922 0.83 DRD2 (0.61) DRD3DRD2DRD4MAPTTP53
SCHEMBL7599786 0.83 DRD2 (0.66) DRD3DRD2DRD4MAPTTP53
SCHEMBL7600056 0.82 DRD3 (0.54) DRD3DRD2DRD4FAAHMAPT
SCHEMBL7601141 0.81 MAPT (0.61) DRD3DRD2DRD4MAPTTP53
SCHEMBL7601974 0.81 DRD2 (0.61) DRD3DRD2DRD4MAPTTP53

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