SCHEMBL15977264

SCHEMBL15977264

CC(C)(C)[Si](C)(C)OCC1NCCc2c1[nH]c1ccccc21

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.56
HTR7 P34969 9/20 0.52
CHRM4 P08173 5/20 0.52
CTSK P43235 1/20 0.52
DRD2 P14416 3/20 0.52
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
MAPKAPK2 P49137 1/20 0.45
HTR2A P28223 2/20 0.44
HTR2C P28335 2/20 0.44

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
SCHEMBL3476675 0.84 KDM4E (0.43) GRIN2BHTR7CHRM4DRD2HTR2A
SCHEMBL21883968 0.77 GRIN2B (0.70) GRIN2BHTR7CHRM4CTSKDRD2
SCHEMBL29756361 0.77 GRIN2B (0.70) GRIN2BHTR7CHRM4CTSKDRD2
SCHEMBL8322968 0.77 GRIN2B (0.70) GRIN2BHTR7CHRM4CTSKDRD2
SCHEMBL10924004 0.74 GRIN2B (0.70) GRIN2BHTR7CHRM4CTSKDRD2
SCHEMBL5532807 0.74 GRIN2B (0.70) GRIN2BHTR7CHRM4CTSKDRD2
SCHEMBL34463426 0.74 GRIN2B (0.65) GRIN2BHTR7CHRM4CTSKDRD2
SCHEMBL18669422 0.74 GRIN2B (0.65) GRIN2BHTR7CHRM4CTSKDRD2
Xestoamine SCHEMBL2271935 0.74 GRIN2B (0.65) GRIN2BHTR7CHRM4CTSKDRD2
Xestoamine SCHEMBL6087465 0.73 GRIN2B (0.64) GRIN2BHTR7CHRM4CTSKDRD2

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-2476680-B1 (1-Azinone)-Substituted Pyridoindoles ALBANY MOLECULAR RES INC (US) 2014-08-27 EP disclosed