SCHEMBL1689060

SCHEMBL1689060

O=c1c2cn(-c3ccccc3)nc2nc(-c2ccc(-c3ccoc3)cc2)n1-c1ccc(Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.53
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
HSP90AA1 P07900 1/20 0.42
HTT P42858 2/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40
CNR1 P21554 2/20 0.39
GPR55 Q9Y2T6 2/20 0.39
CNR2 P34972 1/20 0.39
GRM5 P41594 1/20 0.38
GRM1 Q13255 1/20 0.38
MAPK1 P28482 1/20 0.38
PTGS2 P35354 2/20 0.37
GPR35 Q9HC97 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL1689243 0.90 MAPT (0.51) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL5611687 0.88 MAPT (0.52) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL1689094 0.87 ALDH1A1 (0.52) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL5612533 0.86 MAPT (0.45) ALDH1A1POLBMAPTKMT2AMEN1
SCHEMBL1689138 0.86 ALDH1A1 (0.53) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL1689151 0.85 MAPT (0.41) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL1689182 0.85 MAPT (0.43) ALDH1A1SMN1; SMN2LMNAMAPTKMT2A
SCHEMBL1688969 0.85 MAPT (0.49) ALDH1A1MAPTKMT2AMEN1HSP90AA1
SCHEMBL1688924 0.84 MAPT (0.43) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL1689009 0.83 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2MAPTKMT2AMEN1

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
EP-1807429-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM, LLC (BM) 2007-07-18 EP claimed
WO-2006047516-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2006-05-04 WO claimed
EP-1807429-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM, LLC (BM) 2007-07-18 EP disclosed
WO-2006047516-A2 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2006-05-04 WO disclosed