SCHEMBL7602250

SCHEMBL7602250

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
ADRA1A P35348 3/20 0.51
ADRA1D P25100 2/20 0.51
ADRA1B P35368 2/20 0.51
DRD2 P14416 3/20 0.50
DRD4 P21917 3/20 0.50
DRD3 P35462 3/20 0.50
HTR7 P34969 3/20 0.48
ALDH1A1 P00352 1/20 0.47
MCHR1 Q99705 1/20 0.47
MAPT P10636 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HTT P42858 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
POLB P06746 2/20 0.46
TP53 P04637 1/20 0.46
HTR2A P28223 2/20 0.46
HTR2C P28335 2/20 0.46
SLC6A4 P31645 2/20 0.46

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
SCHEMBL7602249 0.80 ADRA1D (0.77) MEN1KMT2AADRA1AADRA1DADRA1B
SCHEMBL7602227 0.76 MEN1 (0.55) MEN1KMT2AADRA1AADRA1DADRA1B
SCHEMBL8371535 0.76 MEN1 (0.65) MEN1KMT2ADRD2DRD4DRD3
SCHEMBL7596123 0.76 ADRA1D (0.64) MEN1KMT2AADRA1AADRA1DADRA1B
SCHEMBL7597676 0.75 ADRA1D (0.63) MEN1KMT2AADRA1AADRA1DADRA1B
SCHEMBL8517234 0.74 MEN1 (0.55) MEN1KMT2AADRA1AADRA1DADRA1B
SCHEMBL7603299 0.74 ADRA1D (0.62) MEN1KMT2AADRA1AADRA1DADRA1B
SCHEMBL7596968 0.74 ADRA1D (0.59) MEN1KMT2AADRA1AADRA1DADRA1B
SCHEMBL5666060 0.73 MEN1 (0.55) MEN1KMT2AADRA1ADRD2DRD4
SCHEMBL7597607 0.72 MEN1 (0.67) MEN1KMT2AADRA1AADRA1BDRD2

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