SCHEMBL21533266

SCHEMBL21533266

N#CC1(c2cccc(Cl)c2Cc2ccc3c(c2)CC(=O)N3)CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 4/20 0.41
▸ PGR P06401 4/20 0.41
▸ MAOB P27338 3/20 0.41
▸ GRIA1 P42261 2/20 0.39
▸ CACNG8 Q8WXS5 2/20 0.39
▸ SMYD3 Q9H7B4 1/20 0.36
▸ HTR1A P08908 4/20 0.36
▸ DRD2 P14416 4/20 0.36
▸ HTR2A P28223 4/20 0.36
▸ ADRA1D P25100 1/20 0.36
▸ ADRA1A P35348 1/20 0.36
▸ ADRA1B P35368 1/20 0.36
▸ CMA1 P23946 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ IL4I1 Q96RQ9 1/20 0.35
▸ PDK2 Q15119 1/20 0.33

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
SCHEMBL18189499 0.79 GRIA1 (0.55) AHRPGRGRIA1CACNG8CMA1
SCHEMBL18189657 0.75 GRIA1 (0.53) AHRPGRGRIA1CACNG8CMA1
SCHEMBL6904021 0.68 AHR (0.53) AHRPGRMAOBGRIA1CACNG8
SCHEMBL10420660 0.68 AHR (0.51) AHRPGRMAOBGRIA1CACNG8
SCHEMBL18669097 0.67 AHR (0.51) AHRPGRMAOBGRIA1CACNG8
SCHEMBL3570265 0.67 GRIA1 (0.49) AHRPGRMAOBGRIA1CACNG8
SCHEMBL24570672 0.66 AHR (0.61) AHRPGRMAOBGRIA1CACNG8
SCHEMBL4551223 0.66 AHR (0.49) AHRPGRMAOBGRIA1CACNG8
SCHEMBL8670836 0.66 AHR (0.59) AHRPGRMAOBGRIA1CACNG8
SCHEMBL24192175 0.66 AHR (0.51) AHRPGRMAOBGRIA1CACNG8

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-3288935-B1 INDOLONE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-10-30 — — EP disclosed
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