SCHEMBL5573072

SCHEMBL5573072

CCCN1Cc2ccccc2C1(O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.51
MDM2 Q00987 1/20 0.38
LMNA P02545 2/20 0.38
ATM Q13315 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
EBP Q15125 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL5573856 0.88 HTT (0.41) OPRM1MDM2ATMHTTEBP
SCHEMBL5569403 0.80 OPRM1 (0.50) OPRM1EBPSIGMAR1
SCHEMBL9037683 0.73 SIGMAR1 (0.49) OPRM1EBPSIGMAR1
SCHEMBL9040998 0.72 SIGMAR1 (0.47) OPRM1EBPSIGMAR1
SCHEMBL9040061 0.72 SIGMAR1 (0.50) OPRM1EBPSIGMAR1
SCHEMBL29635337 0.71 MAPK1 (0.40) OPRM1SMN1; SMN2
SCHEMBL5573928 0.70 OPRM1 (0.42) OPRM1MDM2SIGMAR1
SCHEMBL30472318 0.68 MAPK1 (0.39) LMNANPSR1HTTSMN1; SMN2SIGMAR1
SCHEMBL9831147 0.68 OPRM1 (0.40) OPRM1
SCHEMBL6589626 0.67 RXFP1 (0.50) OPRM1LMNANPSR1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1786773-A1 ISOINDOLIN-1-ONE DERIVATIVES Cancer Research Technology Limited (GB) 2007-05-23 EP disclosed
WO-2006024837-A1 ISOINDOLIN-1-ONE DERIVATIVES CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2006-03-09 WO disclosed