SCHEMBL23940345

SCHEMBL23940345

CCCCCCCCCCCCCN(CCCCCCCCCCCC)CCN(CCCCCCCCCCCC)CCN1CCNCC1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 8/20 0.45
GNAI3 P08754 7/20 0.45
GNAI1 P63096 7/20 0.45
SIGMAR1 Q99720 4/20 0.44
CXCR4 P61073 2/20 0.41
SOD3 P08294 2/20 0.40
HRH2 P25021 1/20 0.36
HRH1 P35367 1/20 0.36
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL19032524 1.00 GNAO1 (0.45) GNAO1GNAI3GNAI1SIGMAR1CXCR4
SCHEMBL19032353 1.00 GNAO1 (0.45) GNAO1GNAI3GNAI1SIGMAR1CXCR4
SCHEMBL19032776 1.00 GNAO1 (0.45) GNAO1GNAI3GNAI1SIGMAR1CXCR4
SCHEMBL19040685 1.00 GNAO1 (0.45) GNAO1GNAI3GNAI1SIGMAR1CXCR4
SCHEMBL19040849 0.98 GNAO1 (0.46) GNAO1GNAI3GNAI1SIGMAR1CXCR4
SCHEMBL19032598 0.98 GNAO1 (0.46) GNAO1GNAI3GNAI1SIGMAR1CXCR4
SCHEMBL7994696 0.91 SIGMAR1 (0.49) GNAO1GNAI3GNAI1SIGMAR1CXCR4
SCHEMBL19032635 0.91 SIGMAR1 (0.39) GNAO1GNAI3GNAI1SIGMAR1CXCR4
SCHEMBL29255853 0.91 GNAO1 (0.41) GNAO1GNAI3GNAI1SIGMAR1CXCR4
SCHEMBL30596806 0.89 GNAO1 (0.40) GNAO1GNAI3GNAI1SIGMAR1CXCR4

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
EP-3896164-A1 POLYNUCLEOTIDES ENCODING ALPHA-GALACTOSIDASE A FOR THE TREATMENT OF FABRY DISEASE ModernaTX, Inc. (US) 2021-10-20 EP disclosed