SCHEMBL7597598

SCHEMBL7597598

Cc1ccc(C)c(N2CCN(CCCNC(=O)C(C)(O)c3ccc(Cl)c(Cl)c3)CC2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.58
POLB P06746 3/20 0.58
TP53 P04637 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
DRD4 P21917 5/20 0.56
DRD2 P14416 4/20 0.56
DRD3 P35462 3/20 0.56
MAPK1 P28482 2/20 0.52
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HTT P42858 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 3/20 0.47
HSD17B10 Q99714 2/20 0.47
GSK3B P49841 1/20 0.47
GAA P10253 1/20 0.47
ALOX15 P16050 1/20 0.47
USP2 O75604 1/20 0.47
MCL1 Q07820 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
SCHEMBL7601112 0.91 MAPT (0.68) MAPTPOLBTP53SMN1; SMN2DRD4
SCHEMBL7604922 0.90 DRD2 (0.61) MAPTPOLBTP53SMN1; SMN2DRD4
SCHEMBL7601141 0.88 MAPT (0.61) MAPTPOLBTP53SMN1; SMN2DRD4
SCHEMBL7601672 0.87 DRD2 (0.59) MAPTPOLBTP53SMN1; SMN2DRD4
SCHEMBL7600856 0.87 DRD2 (0.59) MAPTPOLBTP53SMN1; SMN2DRD4
SCHEMBL7596945 0.87 DRD2 (0.59) MAPTPOLBTP53SMN1; SMN2DRD4
SCHEMBL7599223 0.86 DRD2 (0.56) MAPTPOLBTP53SMN1; SMN2DRD4
SCHEMBL7601780 0.85 MAPT (0.58) MAPTPOLBTP53SMN1; SMN2DRD4
SCHEMBL7601978 0.85 POLB (0.69) MAPTPOLBTP53SMN1; SMN2DRD4
SCHEMBL7599786 0.84 DRD2 (0.66) MAPTPOLBTP53SMN1; SMN2DRD4

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