SCHEMBL5521883

SCHEMBL5521883

CCOC(=O)Cc1c(C(=O)OCC)c2cc(O)ccc2n1-c1cccc(OCC)c1OCC

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ALOX5 P09917 9/20 0.47
TSHR P16473 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PTGES O14684 1/20 0.45
KDM4E B2RXH2 4/20 0.45
LMNA P02545 3/20 0.45
GAA P10253 2/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MAPT P10636 3/20 0.44
PKM P14618 2/20 0.44
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
ALOX15 P16050 1/20 0.43

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
SCHEMBL333352 0.85 ALOX5 (0.58) MEN1KMT2AALOX5TSHRNPSR1
SCHEMBL333454 0.80 MEN1 (0.74) MEN1KMT2AALOX5TSHRNPSR1
SCHEMBL333666 0.79 PTGES (0.64) MEN1KMT2AALOX5TSHRNPSR1
SCHEMBL333866 0.78 MEN1 (0.59) MEN1KMT2AALOX5TSHRNPSR1
SCHEMBL334043 0.76 PTGES (0.61) MEN1KMT2AALOX5TSHRNPSR1
SCHEMBL333699 0.75 MAPT (0.61) MEN1KMT2AALOX5TSHRNPSR1
SCHEMBL333920 0.75 KMT2A (0.57) MEN1KMT2AALOX5TSHRNPSR1
SCHEMBL333953 0.75 KMT2A (0.60) MEN1KMT2AALOX5TSHRNPSR1
SCHEMBL333739 0.74 KMT2A (0.62) MEN1KMT2AALOX5TSHRNPSR1
SCHEMBL333681 0.74 ALOX5 (0.52) MEN1KMT2AALOX5TSHRNPSR1

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-1841735-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-10 EP disclosed
WO-2006077366-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-07-27 WO disclosed