SCHEMBL7079236

SCHEMBL7079236

COc1ccc(Br)cc1C1(c2ccccc2)CCN(CCCNC(=O)OC(C)(C)C)CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 12/20 0.57
ADRA1A P35348 4/20 0.49
SIGMAR1 Q99720 2/20 0.46
ADRA2A P08913 3/20 0.44
ADRA2B P18089 3/20 0.44
ADRA2C P18825 3/20 0.44
ADRA1D P25100 3/20 0.44
ADRA1B P35368 3/20 0.44
DRD3 P35462 3/20 0.44
DRD4 P21917 2/20 0.43

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
SCHEMBL6215791 0.90 DRD2 (0.58) DRD2ADRA1ASIGMAR1ADRA2AADRA2B
SCHEMBL7234672 0.90 DRD2 (0.59) DRD2ADRA1ASIGMAR1ADRA1DADRA1B
SCHEMBL7681348 0.82 DRD2 (0.51) DRD2ADRA1ASIGMAR1
SCHEMBL6969864 0.81 HTR7 (0.40) DRD2ADRA1ASIGMAR1DRD3
SCHEMBL6969857 0.80 DRD3 (0.43) ADRA1ASIGMAR1DRD3
SCHEMBL7566269 0.77 DRD2 (0.63) DRD2ADRA1ASIGMAR1ADRA1DADRA1B
SCHEMBL6216974 0.76 DRD2 (0.57) DRD2ADRA1ASIGMAR1ADRA2AADRA2B
SCHEMBL6197779 0.76 DRD2 (0.55) DRD2ADRA1ASIGMAR1ADRA2AADRA2B
SCHEMBL7524346 0.76 ADRA1A (0.57) DRD2ADRA1ASIGMAR1ADRA2AADRA2B
SCHEMBL6198575 0.76 DRD2 (0.55) DRD2ADRA1ASIGMAR1ADRA2AADRA2B

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6620815-B1 Selective antagonists for human alpha 1A receptors; benign prostatic hyperplasia, impotency, cardiac arrhythmia treatment; anticholesterol agents; intraocular pressure reduction SYNAPTIC PHARMACEUTICAL CORPORATION 2003-09-16 US disclosed
EP-0988295-A4 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMA CORP (US) 2003-08-13 EP disclosed
US-6159990-A Oxazolidinones as α1A receptor antagonists SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-12-12 US disclosed
EP-0988295-A1 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-03-29 EP disclosed
WO-1998057940-A1 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-12-23 WO disclosed