SCHEMBL9483410

SCHEMBL9483410

CC(C)(C)OC(=O)N1CCN(CC(Cc2ccc(OS(=O)(=O)c3cccc4cnccc34)cc2)NS(=O)(=O)c2cccc3cnccc23)CC1

nearest known ligand 0.79

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 19/20 0.79
▸ ALDH1A1 P00352 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ CAMK2D Q13557 1/20 0.52
▸ P2RX4 Q99571 1/20 0.52
▸ CAMK2A Q9UQM7 1/20 0.52

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
SCHEMBL9483491 0.88 P2RX7 (0.62) P2RX7ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL29565839 0.88 P2RX7 (1.00) P2RX7ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL9483837 0.88 P2RX7 (1.00) P2RX7ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL9483834 0.88 P2RX7 (1.00) P2RX7ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL9636226 0.86 P2RX7 (0.59) P2RX7ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL9483630 0.85 P2RX7 (0.75) P2RX7ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL9483302 0.85 P2RX7 (0.62) P2RX7ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL9483529 0.85 P2RX7 (0.58) P2RX7ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL23374073 0.84 P2RX7 (0.73) P2RX7ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL9483511 0.83 P2RX7 (0.57) P2RX7ALDH1A1SMN1; SMN2LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5245034-A Compound having vessel smooth muscle relaxation activity Hidaka, Kiroyoshi (JP) 1993-09-14 — — US disclosed
US-5081246-A Isoquinolino sulfonamino derivatives Hidaka, Hiroyoshi (JP) 1992-01-14 — — US disclosed
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