SCHEMBL7601974

SCHEMBL7601974

Cc1ccc(C)c(N2CCN(CCCNC(=O)C(O)(c3ccccc3)c3ccccc3)CC2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.61
DRD4 P21917 4/20 0.61
DRD3 P35462 4/20 0.61
ALDH1A1 P00352 2/20 0.59
MAPT P10636 6/20 0.59
TP53 P04637 4/20 0.59
POLB P06746 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
MAPK1 P28482 1/20 0.57
ADRA1D P25100 3/20 0.56
ADRA1A P35348 3/20 0.56
ADRA1B P35368 3/20 0.56
HTT P42858 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
LMNA P02545 2/20 0.53
GSK3B P49841 1/20 0.51
GAA P10253 1/20 0.51
ALOX15 P16050 1/20 0.51

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 0.92 DRD2 (0.59) DRD2DRD4DRD3ALDH1A1MAPT
SCHEMBL7601672 0.92 DRD2 (0.59) DRD2DRD4DRD3ALDH1A1MAPT
SCHEMBL7600856 0.92 DRD2 (0.59) DRD2DRD4DRD3ALDH1A1MAPT
SCHEMBL7601660 0.92 ADRA1D (0.56) DRD2DRD4DRD3ALDH1A1MAPT
SCHEMBL7598982 0.91 DRD2 (0.58) DRD2DRD4DRD3ALDH1A1MAPT
SCHEMBL7597680 0.91 DRD2 (0.60) DRD2DRD4DRD3ALDH1A1MAPT
SCHEMBL7602613 0.89 ADRA1A (0.61) DRD2DRD4DRD3ADRA1DADRA1A
SCHEMBL7600808 0.89 DRD2 (0.58) DRD2DRD4DRD3ALDH1A1MAPT
SCHEMBL7601718 0.88 DRD2 (0.56) DRD2DRD4DRD3ALDH1A1MAPT
SCHEMBL7599234 0.88 POLB (0.72) DRD2DRD4DRD3ALDH1A1MAPT

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