SCHEMBL1966617

SCHEMBL1966617

Cn1ccnc1-c1ccc2c(C(=O)NC3CN4CCC3CC4)n[nH]c2c1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 4/20 0.63
▸ HTR3A P46098 2/20 0.63
▸ USP30 Q70CQ3 1/20 0.46
▸ DYRK1A Q13627 6/20 0.45
▸ GSK3B P49841 4/20 0.45
▸ PAK1 Q13153 1/20 0.43
▸ WNT1 P04628 1/20 0.42
▸ RIPK1 Q13546 1/20 0.42

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
SCHEMBL1967392 1.00 CHRNA7 (0.63) CHRNA7HTR3AUSP30DYRK1AGSK3B
SCHEMBL1965653 1.00 CHRNA7 (0.63) CHRNA7HTR3AUSP30DYRK1AGSK3B
SCHEMBL12339925 0.83 CHRNA7 (0.74) CHRNA7HTR3A
SCHEMBL261083 0.83 CHRNA7 (0.77) CHRNA7HTR3ADYRK1AGSK3B
SCHEMBL261646 0.83 CHRNA7 (0.77) CHRNA7HTR3ADYRK1AGSK3B
SCHEMBL2454962 0.83 CHRNA7 (0.77) CHRNA7HTR3ADYRK1AGSK3B
SCHEMBL1964372 0.82 CHRNA7 (0.61) CHRNA7HTR3AUSP30DYRK1AGSK3B
SCHEMBL5994565 0.82 CHRNA7 (0.61) CHRNA7HTR3AUSP30DYRK1AGSK3B
SCHEMBL1966893 0.82 CHRNA7 (0.61) CHRNA7HTR3AUSP30DYRK1AGSK3B
SCHEMBL492328 0.82 CHRNA7 (0.63) CHRNA7HTR3AUSP30DYRK1AGSK3B

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-2336128-A1 Benzoisothiazoles and preparation and uses thereof Memory Pharmaceuticals Corporation (US) 2011-06-22 — — EP disclosed
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