SCHEMBL2051245

SCHEMBL2051245

COCCNCc1ccc(O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.62
DRD4 P21917 4/20 0.56
SCN8A Q9UQD0 1/20 0.54
BCHE P06276 3/20 0.46
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CHRM2 P08172 1/20 0.44
CHEK1 O14757 1/20 0.44
DRD2 P14416 2/20 0.44
DRD3 P35462 2/20 0.44
ADRA1D P25100 1/20 0.44
ADRA1A P35348 1/20 0.44
ADRA1B P35368 1/20 0.44
HTT P42858 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MITF O75030 1/20 0.43
TMEM97 Q5BJF2 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
KDM4E B2RXH2 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
SCHEMBL8252520 0.82 L3MBTL1 (0.64) L3MBTL1DRD4CHRM2CHEK1HTT
SCHEMBL12317 0.82 L3MBTL1 (0.64) L3MBTL1DRD4SCN8ACA1CA2
SCHEMBL11592004 0.81 MEN1 (0.56) L3MBTL1DRD4SCN8ABCHECA1
SCHEMBL9156034 0.81 L3MBTL1 (0.62) L3MBTL1DRD4SCN8ACHRM2HTT
SCHEMBL2312495 0.81 CHRM2 (0.68) L3MBTL1SCN8ABCHECA1CA2
SCHEMBL6325754 0.81 L3MBTL1 (0.67) L3MBTL1DRD4SCN8ACA1CA2
SCHEMBL1241301 0.81 L3MBTL1 (0.62) L3MBTL1CA1CA2CHRM2HTT
SCHEMBL11304095 0.81 L3MBTL1 (0.67) L3MBTL1BCHECA1CA2CHRM2
SCHEMBL556793 0.80 MEN1 (0.64) L3MBTL1DRD4SCN8ACHRM2DRD2
Hydrochloric Acid SCHEMBL16097364 0.79 L3MBTL1 (0.70) L3MBTL1BCHECA1CA2CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013059137-A1 HIGH MOLECULAR WEIGHT ZWITTERION-CONTAINING POLYMERS OLIGASIS (US) 2013-04-25 WO disclosed
EP-2512462-A1 MULTIFUNCTIONAL ZWITTERIONIC POLYMER CONJUGATES Oligasis (US) 2012-10-24 EP disclosed
WO-2011075736-A1 MULTIFUNCTIONAL ZWITTERIONIC POLYMER CONJUGATES OLIGASIS (US) 2011-06-23 WO disclosed
WO-2008063572-A2 METHOD FOR STORING HYDROGEN USING NOVEL CARBON-BASED HIGH CAPACITY STORAGE MATERIALS ALGODIGN, LLC (US) 2008-05-29 WO disclosed