SCHEMBL7601780

SCHEMBL7601780

Cc1ccc(C)c(N2CCN(CCCNC(=O)C(C)(O)c3ccccc3Cl)CC2)c1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.58
TP53 P04637 7/20 0.58
POLB P06746 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
DRD2 P14416 4/20 0.57
DRD4 P21917 3/20 0.57
DRD3 P35462 2/20 0.56
LMNA P02545 3/20 0.52
MAPK1 P28482 1/20 0.52
ALDH1A1 P00352 1/20 0.52
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
HTT P42858 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ADRA1D P25100 1/20 0.49
ADRA1A P35348 1/20 0.49
ADRA1B P35368 1/20 0.49

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
SCHEMBL7603601 0.87 DRD3 (0.57) MAPTTP53POLBSMN1; SMN2DRD2
SCHEMBL7600856 0.87 DRD2 (0.59) MAPTTP53POLBSMN1; SMN2DRD2
SCHEMBL7601672 0.87 DRD2 (0.59) MAPTTP53POLBSMN1; SMN2DRD2
SCHEMBL7596945 0.87 DRD2 (0.59) MAPTTP53POLBSMN1; SMN2DRD2
SCHEMBL7597598 0.85 MAPT (0.58) MAPTTP53POLBSMN1; SMN2DRD2
SCHEMBL7601112 0.85 MAPT (0.68) MAPTTP53POLBSMN1; SMN2DRD2
SCHEMBL7604922 0.84 DRD2 (0.61) MAPTTP53POLBSMN1; SMN2DRD2
SCHEMBL7601141 0.84 MAPT (0.61) MAPTTP53POLBSMN1; SMN2DRD2
SCHEMBL7599786 0.84 DRD2 (0.66) MAPTTP53POLBSMN1; SMN2DRD2
SCHEMBL7599223 0.83 DRD2 (0.56) MAPTTP53POLBSMN1; SMN2DRD2

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