SCHEMBL7218274

SCHEMBL7218274

Cc1ccc(C2CCN(CCCNC(=O)N3C(=O)OCC3c3ccc(F)c(F)c3)CC2)s1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 20/20 0.57
ADRA1B P35368 18/20 0.57
ADRA1D P25100 17/20 0.57
HRH1 P35367 2/20 0.57
ADRA2A P08913 1/20 0.49
ADRA2B P18089 1/20 0.49
ADRA2C P18825 1/20 0.49

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
SCHEMBL7212035 0.86 ADRA1A (0.59) ADRA1AADRA1BADRA1DHRH1ADRA2A
SCHEMBL5662332 0.81 ADRA1A (0.55) ADRA1AADRA1BADRA1DHRH1
SCHEMBL5660423 0.81 ADRA1A (0.55) ADRA1AADRA1BADRA1DHRH1
SCHEMBL7213199 0.79 ADRA1A (0.63) ADRA1AADRA1BADRA1DHRH1
SCHEMBL7226013 0.76 ADRA1A (0.66) ADRA1AADRA1BADRA1DHRH1ADRA2A
SCHEMBL7212013 0.76 ADRA1A (0.55) ADRA1AADRA1BADRA1DHRH1
SCHEMBL7213122 0.76 ADRA1A (0.59) ADRA1AADRA1BADRA1DHRH1
SCHEMBL5662392 0.75 MCHR1 (0.57) ADRA1AADRA1BADRA1DHRH1
SCHEMBL7747511 0.75 ADRA1A (0.57) ADRA1AADRA1BADRA1DHRH1ADRA2A
SCHEMBL7747513 0.75 ADRA1A (0.57) ADRA1AADRA1BADRA1DHRH1ADRA2A

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 1 patent. 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