SCHEMBL6962969

SCHEMBL6962969

CC(C#N)CN1CCC(c2ccccn2)CC1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 15/20 0.46
DRD2 P14416 9/20 0.44
DRD3 P35462 6/20 0.44
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
USP30 Q70CQ3 1/20 0.39
KDM5A P29375 1/20 0.39

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
SCHEMBL6964421 0.80 DRD4 (0.47) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL31127629 0.78 DRD4 (0.52) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL10819399 0.77 DRD4 (0.54) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL6197454 0.77 DRD4 (0.49) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL6961089 0.76 OPRM1 (0.42) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL6198664 0.75 DRD4 (0.47) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL7833509 0.75 DRD2 (0.59) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL16218248 0.74 CHRM2 (0.47) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL31754475 0.74 USP30 (0.57) DRD4CHRM2CHRM4CHRM5CHRM1
SCHEMBL13995496 0.74 ADRA1D (0.48) DRD4DRD2DRD3ADRA1DADRA1A

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