SCHEMBL1968174

SCHEMBL1968174

O=C(NC1CN2CCC1CC2)c1n[nH]c2cc(C3CCCCC3)ccc12

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 8/20 0.69
HTR3A P46098 3/20 0.69
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
GSK3B P49841 1/20 0.47
HTR3E A5X5Y0 1/20 0.42
HTR3B O95264 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
HTR3D Q70Z44 1/20 0.42
HTR3C Q8WXA8 1/20 0.42
USP30 Q70CQ3 1/20 0.42
PRKAB2 O43741 1/20 0.42
PRKAG1 P54619 1/20 0.42
PRKAA2 P54646 1/20 0.42
PRKAA1 Q13131 1/20 0.42
PRKAG3 Q9UGI9 1/20 0.42
PRKAG2 Q9UGJ0 1/20 0.42
PRKAB1 Q9Y478 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
SCHEMBL1967348 1.00 CHRNA7 (0.69) CHRNA7HTR3ANPC1RAB9AGSK3B
SCHEMBL1965172 1.00 CHRNA7 (0.69) CHRNA7HTR3ANPC1RAB9AGSK3B
SCHEMBL1963244 0.99 CHRNA7 (0.70) CHRNA7HTR3ANPC1RAB9AGSK3B
SCHEMBL1965004 0.99 CHRNA7 (0.70) CHRNA7HTR3ANPC1RAB9AGSK3B
SCHEMBL1969429 0.91 CHRNA7 (0.70) CHRNA7HTR3ANPC1RAB9AGSK3B
SCHEMBL1964774 0.91 CHRNA7 (0.70) CHRNA7HTR3ANPC1RAB9AGSK3B
SCHEMBL1965143 0.91 CHRNA7 (0.70) CHRNA7HTR3ANPC1RAB9AGSK3B
SCHEMBL1966222 0.90 CHRNA7 (0.66) CHRNA7HTR3APRKAB2PRKAG1PRKAA2
SCHEMBL1964032 0.90 CHRNA7 (0.66) CHRNA7HTR3APRKAB2PRKAG1PRKAA2
SCHEMBL261046 0.87 CHRNA7 (0.72) CHRNA7HTR3AGSK3BHTR3EHTR3B

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